DOCSLIB.ORG

Amended Safety Assessment of Methylisothiazolinone and Methylchloroisothiazolinone As Used in Cosmetics

Total Page：16

File Type：pdf, Size：1020Kb

Download full-text PDF Read full-text
Amended Safety Assessment of Methylisothiazolinone and Methylchloroisothiazolinone As Used in Cosmetics Amended Safety Assessment of Methylisothiazolinone and Methylchloroisothiazolinone as Used in Cosmetics Status: Draft Report for Panel Review Release Date: May 10, 2019 Panel Meeting Date: June 6-7, 2019 The 2019 Cosmetic Ingredient Review Expert Panel members are: Chair, Wilma F. Bergfeld, M.D., F.A.C.P.; Donald V. Belsito, M.D.; Curtis D. Klaassen, Ph.D.; Daniel C. Liebler, Ph.D.; Ronald A. Hill, Ph.D. James G. Marks, Jr., M.D.; Ronald C. Shank, Ph.D.; Thomas J. Slaga, Ph.D.; and Paul W. Snyder, D.V.M., Ph.D. The CIR Executive Director is Bart Heldreth, Ph.D. This safety assessment was prepared by Christina L. Burnett, Senior Scientific Analyst/Writer. © Cosmetic Ingredient Review 1620 L St NW, Suite 1200 ◊ Washington, DC 20036-4702 ◊ ph 202.331.0651 ◊fax 202.331.0088 ◊ [email protected] Distributed for Comment Only -- Do Not Cite or Quote Commitment & Credibility since 1976 Memorandum To: CIR Expert Panel Members and Liaisons From: Christina L. Burnett, Senior Scientific Writer/Analyst Date: May 10, 2019 Subject: Draft Amended Report on the Safety Assessment on Methylisothiazolinone and Methylchloroisothiazolinone Enclosed is the draft amended report of the safety assessment of Methylisothiazolinone and Methylchloroisothiazolinone (MCI/MI) as used in cosmetics. (It is identified as mcimi062019rep in the pdf document.) This ingredient combination functions as a preservative in cosmetics. In 1992, the final report on MCI/MI was published with the conclusion that this mixture may be safely used in rinse-off products at a concentration not to exceed 15 ppm and in leave-on cosmetic products at a concentration not to exceed 7.5 ppm. (Minutes from the Panel discussions from 1987 to 1990 are identified as mcimi062019min_orig in the pdf document, while minutes from the more recent Panel discussions are identified as mcimi062019min.) At the April 2019 meeting, the Panel voted to re-open this safety assessment to reassess the conclusion based on the numerous sensitization studies and reports that have been published since 1992. The relevant data from these studies have been included in this draft report, along with summary information from the original report (indicated by italics). According to 2019 VCRP data, MCI and MI are reported separately and not as a mixture. The total number of uses reported for MCI are 5137; 480 of these are in leave-on products. MI has 6037 reported uses; 1042 of these are in leave-on products. The uses have increased significantly since the original report on MCI/MI was published; the 1986 total number of uses for the ingredient mixture was 381. Currently, the Council has reported the results of their survey that indicate MCI/MI (3:1) is used at up to 7.5 ppm in leave-on products and at up to 15 ppm in rinse-off products. In the original report, the ingredient combination was reported to be used at up to 1% in both leave-on and rinse-off products. Comments from the Council on the re-review document have been addressed and are included in this report package (mcimi062019pcpc). Data received since the April meeting include an open human repeated insult patch test of 12 ppm MCI/MI in a hand wash, updated concentration of use data, and the QRA2 risk assessment of MCI/MI performed by the CIR Science and Support Committee (mcimi062019data1 through mcimi062019data4). These data have been incorporated into the report and highlighted in yellow. If no further data are needed to reach a conclusion of safety, the Panel should formulate a Discussion and issue a Tentative Amended Report. However, if additional data are required, the Panel should be prepared to identify those needs and issue an Insufficient Data Announcement (IDA). __________________________________________________________________________________________ 1620 L St NW, Suite 1200, Washington, DC 20036 (Main) 202-331-0651 (Fax) 202-331-0088 (Email) [email protected] (Website) www.cir-safety.org Distributed for Comment Only -- Do Not Cite or Quote RE-REVIEW FLOW CHART INGREDIENT/FAMILY_____Methylisothiazolinone and Methylchlorothiazolinone ______ MEETING _______ June 2019___________________________________________________________ Public Comment CIR Expert Panel Re-Review Rpt Status New Data; or announce > 15 years OR request since last review JACT 11(1), 1992 Re-review to Panel PRIORITY LIST Apr 2019 Are new data cause to reopen? April 2019: Panel re- confirmed the decision to re-open this report YES NO DRAFT AMENDED REPORT DAR Are new ingredients June 2019 appropriate for inclusion/re-open? Table Table IDA TAR Yes No IDA Notice IDA RE-REVIEW Admin Book DRAFT TENTATIVE SUMMARY AMENDED REPORT Draft TAR Table Table Tentative Amended Report Issue TAR Draft FAR DRAFT FINAL 60 day Public comment period AMENDED REPORT Table Table Different Conclusion Final Amended Issue PUBLISH Report FAR Distributed for Comment Only -- Do Not Cite or Quote MCI/MI History 1992 – Safety Assessment of Methylisothiazolinone/Methylchloroisothiazolinone is published in the Journal of American College of Toxicology. April 2019 – Based on the multiple reported incidences of sensitization reported globally since the original report was published and the large number of uses being reported to the VCRP database, the Panel re-opened the safety assessment on MCI/MI to amend the current conclusion. Prior to determining the new conclusion, however, the Panel is awaiting the results of a second-generation quantitative risk assessment (QRA 2.0) calculation to be performed by industry stakeholders. Distributed for Comment Only -- Do Not Cite or Quote MCI/MI Data Profile* – June 2019 – Christina Burnett Repeated Dermal Dermal Ocular Clinical Toxicokinetics Acute Tox DART Genotox Carci Dose Tox Irritation Sensitization Irritation Studies ow Mfg ro /log K /log Vitro n Vit log P log Animal Retrospective/ Constituents/ Impurities Dermal Oral Inhalation Dermal Oral I In Vivo Dermal Oral In Vitro Animal Human In Vitro Animal Human Phototoxicity In Multicenter Case Reports Reported Use Method of Dermal Penetration ADME Dermal Oral Inhalation 1992 Report Data X X X X X X X X X X X X X X X X X X X X X 2019 Re-review X X X X X X X X * “X” indicates that data were available in a category for the ingredient 1 Distributed for Comment Only -- Do Not Cite or Quote MCI/MI – Christina Burnett Ingredient CAS # SciFin PubMed FDA EU ECHA SIDS ECETOC HPVIS NICNAS NTIS NTP WHO FAO NIOSH Web Methylchloroisot 26172-55-4 similar results Approve Annex Dossier hiazolinone/ and to below d for V only for Methylisothiazoli 2682-20-4 PubMed indirect MI none results food products MCI/MI – published in 1992 with the conclusion that this mixture may be safely used in rinse-off products at a concentration not to exceed 15 ppm and in leave-on cosmetic products at a concentration not to exceed 7.5 ppm. Search Strategy/PubMed – Search Performed in February 2019 Methylchloroisothiazolinoe OR Kathon – 541 hits 90 references ordered or downloaded. Search updated - April 24, 2019 Distributed for Comment Only -- Do Not Cite or Quote LINKS Search Engines . Pubmed (- http://www.ncbi.nlm.nih.gov/pubmed) . Scifinder (https://scifinder.cas.org/scifinder) appropriate qualifiers are used as necessary search results are reviewed to identify relevant documents Pertinent Websites . wINCI - http://webdictionary.personalcarecouncil.org . FDA databases http://www.ecfr.gov/cgi-bin/ECFR?page=browse . FDA search databases: http://www.fda.gov/ForIndustry/FDABasicsforIndustry/ucm234631.htm;, . EAFUS: http://www.accessdata.fda.gov/scripts/fcn/fcnnavigation.cfm?rpt=eafuslisting&displayall=true . GRAS listing: http://www.fda.gov/food/ingredientspackaginglabeling/gras/default.htm . SCOGS database: http://www.fda.gov/food/ingredientspackaginglabeling/gras/scogs/ucm2006852.htm . Indirect Food Additives: http://www.accessdata.fda.gov/scripts/fdcc/?set=IndirectAdditives . Drug Approvals and Database: http://www.fda.gov/Drugs/InformationOnDrugs/default.htm . http://www.fda.gov/downloads/AboutFDA/CentersOffices/CDER/UCM135688.pdf . FDA Orange Book: https://www.fda.gov/Drugs/InformationOnDrugs/ucm129662.htm . OTC ingredient list: https://www.fda.gov/downloads/aboutfda/centersoffices/officeofmedicalproductsandtobacco/cder/ucm135688.p df . (inactive ingredients approved for drugs: http://www.accessdata.fda.gov/scripts/cder/iig/ . HPVIS (EPA High-Production Volume Info Systems) - https://ofmext.epa.gov/hpvis/HPVISlogon . NIOSH (National Institute for Occupational Safety and Health) - http://www.cdc.gov/niosh/ . NTIS (National Technical Information Service) - http://www.ntis.gov/ . NTP (National Toxicology Program ) - http://ntp.niehs.nih.gov/ . Office of Dietary Supplements https://ods.od.nih.gov/ . FEMA (Flavor & Extract Manufacturers Association) - http://www.femaflavor.org/search/apachesolr_search/ . EU CosIng database: http://ec.europa.eu/growth/tools-databases/cosing/ . ECHA (European Chemicals Agency – REACH dossiers) – http://echa.europa.eu/information-on- chemicals;jsessionid=A978100B4E4CC39C78C93A851EB3E3C7.live1 . ECETOC (European Centre for Ecotoxicology and Toxicology of Chemicals) - http://www.ecetoc.org . European Medicines Agency (EMA) - http://www.ema.europa.eu/ema/ . IUCLID (International Uniform Chemical Information Database) - https://iuclid6.echa.europa.eu/search . OECD SIDS (Organisation for Economic Co-operation and Development Screening Info Data Sets)- http://webnet.oecd.org/hpv/ui/Search.aspx . SCCS (Scientific Committee for Consumer Safety) opinions: http://ec.europa.eu/health/scientific_committees/consumer_safety/opinions/index_en.htm
Load more

Recommended publications
  • Isothiazolinone
    Patient Information Cl+ Me– Isothiazolinone Your TRUE TEST ® indicates that you have a contact allergy to Cl+ Me– Isothiazolinone. Cl+ Me– Isothiazolinone in contact with your skin may result in dermatitis. Brief or occasional contact may not pose a problem. Cl+ Me– Isothiazolinone (Kathon CG ®) is a preservative with a broad spectrum of application, and is effective against bacteria, fungi, yeast and algae. Where is Cl+ Me– Isothiazolinone found? Cl+ Me– Isothiazolinone is found in many cosmetics and toiletries such as moisturizers, foundations, powders, self-tanners, sunscreens, makeup removers, eye shadows, mascaras, shampoos, liquid soaps, hair conditioners, gels, baby wipes, some toilet papers etc. It is found in topical medicines, detergents, fabric softeners, cleansers, pesticides and polishes. Industrially Cl+ Me- Isothiazolinone is used as a preservative in waterbased metalworking fluids, water-cooling and slime control agents in paper mills. It may be found in water based paints/lacquers, cleaning agents, printing inks, coloring agents, curing agents, adhesives and glues, impregnating agents and radiography liquids. If you are very sensitive you may react to airborne Cl+ Me- Isothiazolinone released from newly painted rooms where water based paints have been used. 2012 ©SmartPractice Denmark Page 1 of 2 How to avoid Cl+ Me– Isothiazolinone It is important to use only ingredient-labeled cosmetics and other skin care products that do not list Cl+ Me– Isothiazolinone or any of its synonyms on the label. Avoid exposure to chemicals containing Cl+ Me- Isothiazolinone such as water based surface coatings. If you suspect that you are being exposed to this allergen at work, consult your employer regarding Material Safety Data Sheets.
    [Show full text]
  • Isothiazolinone Content of US Consumer Adhesives: Ultrahigh- Performance Liquid Chromatographic Mass Spectrometry Analysis
    HHS Public Access Author manuscript Author ManuscriptAuthor Manuscript Author Dermatitis Manuscript Author . Author manuscript; Manuscript Author available in PMC 2020 March 01. Published in final edited form as: Dermatitis. 2019 ; 30(2): 129–134. doi:10.1097/DER.0000000000000455. Isothiazolinone Content of US Consumer Adhesives: Ultrahigh- Performance Liquid Chromatographic Mass Spectrometry Analysis Molly C. Goodier, BS*,†, Lun-Yi Zang, PhD‡, Paul D. Siegel, PhD‡, and Erin M. Warshaw, MD, MS†,§,∥ * University of Minnesota School of Medicine, Minneapolis Veterans Affairs Medical Center, MN † Department of Dermatology, Minneapolis Veterans Affairs Medical Center, MN ‡ Health Effects Laboratory Division, National Institute for Occupational Safety and Health, Centers for Disease Control and Prevention, Morgantown, WV § Department of Dermatology, University of Minnesota Medical School, Centers for Disease Control and Prevention, Morgantown, WV ∥ Park Nicollet Contact Dermatitis Clinic, Minneapolis, MN. Abstract Background: There are limited data regarding the prevalence and concentration of isothiazolinone preservatives in consumer adhesives. Objectives: The aim of this study was to determine the prevalence and concentration of 5 specific isothiazolinones (methylisothiazolinone [MI], methylchloroisothiazolinone [MCI], benzisothiazolinone [BIT], butyl BIT, and octylisothiazolinone) in US adhesives. Methods: Thirty-eight consumer adhesives were analyzed using ultrahigh-performance liquid chromatographic–mass spectrometry. Fisher exact tests were used to test for isothiazolinone content and: 1) glue format (2) application purpose and 3) extraction method. Results: Nineteen adhesives (50%) had at least 1 isothiazolinone, and 15 contained 2 isothiazolinones. Frequencies and concentrations were as follows:MI (44.7%; 4–133 ppm), MCI (31.6%; 7–27 ppm), BIT (15.8%; 10–86 ppm), and octylisothiazolinone (2.6%; 1 ppm). Butyl BIT was not detected in any of the adhesives.
    [Show full text]
  • Chloromethylisothiazolinone/Methylisothiazolinone, Still a Prevalent Allergen Causing Contact Dermatitis
    Chloromethylisothiazolinone/Methylisothiazolinone, still a prevalent allergen causing Contact Dermatitis Ana M Giménez Arnau1, Wolfgang Uter2, Ramón M Pujol1 1. Department of Dermatology. Hospital del Mar. IMAS. Universitat Autònoma. Barcelona. Spain 2. University Erlangen. Nürnberg. Germany Introduction Isothiazolinones are heterocyclic compounds used as biocides (Fig.1). Five derivatives are used in significant amounts: Methylisothiazolinone (MIT,MI), Chloromethylisothiazolinone (CMIT,CMI,MCI), Benzisothiazolinone (BIT), Octylisothiazolinone (OIT,OI), Dichlorooctylisothiazolinone (DCOIT,DCOI), Butylbenzoisothiazolinone (BBIT). Isothiazolinones are antimicrobials used to control bacteria, fungi and algae in cooling water systems, fuel storage tanks, pulp and paper mill water systems, oil extraction systems, wood preservation and antifouling agents. They are frequently used in personal care products such as shampoos and other hair cair products, as well as certain water-based paints formulations. There, often combinations of MIT and CMIT or MIT and BIT are used.1 Kathon CG is a 3:1 mixture of MIT (1.125%) and MCI (0.375%) with magnesium nitrate and magnesium chloride as stabilizers (23%) and water (75.5%). Initally, using RIPT test no sensitization was observed at 10, 6 or 5 ppm (n=1121) or at 15 ppm (n=200).2 From January 1990, cosmetics products in the EEC should not contain more than 15 ppm. MCI/MIT ratio is disturbed in the 73% of the Kathon-CG-preserved "leave on" cosmetics.3 MCI is significantly stronger sensitizer than MIT and BIT.4
    [Show full text]
  • Bssl V11.0.Pdf
    Content 1 Introduction 3 2 Definitions 3 3 Testing methods 7 4 Scope and validity 8 5 Consumer safety limits 9 Annex I Compilation of single substances Annex II Usage Ranges bluesign® system substances list (BSSL) | v11.0 | December 1, 2020 ©bluesign technologies ag | www.bluesign.com 2 1 Introduction The document specifies the limits for chemical substances in articles. It also defines usage bans for chemical substances prohibited from the manufacturing of articles. It is important to know that due to quantity and range of listed substances and substance groups the consumer safety limits cannot be controlled by testing of articles alone and/or by confirmation declarations from suppliers (conventional RSL and/or testing approach). This is the reason why the bluesign® SYSTEM integrates the up-stream parts of the manufacturing chain including chemical suppliers. Only an input-stream management with an appropriate network of bluesign® SYSTEM PARTNERS leads to comprehensive knowledge on chemical products and assures that restrictions and bans are achieved. Definitions 2.1 Accessory A component of a consumer product which is not classified as textile fabric (e.g. button, label, zipper, etc.) 2.2 Article An object which during production is given a special shape, surface or design, which determines its function to a greater degree than does its chemical composition (fibers, textile fabrics, buttons, zippers, etc.). 2.3 BSSL bluesign® system substances list (BSSL) Consumer safety limits. A list that specifies consumer safety limits for chemical substances in articles. It also defines usage bans for chemical substances prohibited from the manufacturing of articles. 2.4 CAS CAS registry numbers are unique numerical identifiers for chemical elements, compounds, polymers, biological sequences, mixtures and alloys.
    [Show full text]
  • Isothiazolinone Content of US Consumer Adhesives: Ultrahigh
    STUDIES Isothiazolinone Content of US Consumer Adhesives: Ultrahigh-Performance Liquid Chromatographic Mass Spectrometry Analysis 02/07/2020 on BhDMf5ePHKav1zEoum1tQfN4a+kJLhEZgbsIHo4XMi0hCywCX1AWnYQp/IlQrHD3HsbbxaSipcMJ0ThO3aV/oAuxvLDyChWkt91sWC5jaww= by https://journals.lww.com/dermatitis from Downloaded Molly C. Goodier, BS,*† Lun-Yi Zang, PhD,‡ Paul D. Siegel, PhD,‡ and Erin M. Warshaw, MD, MS†§|| Downloaded from Background: There are limited data regarding the prevalence and concentration of isothiazolinone preservatives in con- https://journals.lww.com/dermatitis sumer adhesives. Objectives: The aim of this study was to determine the prevalence and concentration of 5 specific isothiazolinones (methylisothiazolinone [MI], methylchloroisothiazolinone [MCI], benzisothiazolinone [BIT], butyl BIT, and octylisothiazolinone) in US adhesives. Methods: Thirty-eight consumer adhesives were analyzed using ultrahigh-performance liquid chromatographic–mass by BhDMf5ePHKav1zEoum1tQfN4a+kJLhEZgbsIHo4XMi0hCywCX1AWnYQp/IlQrHD3HsbbxaSipcMJ0ThO3aV/oAuxvLDyChWkt91sWC5jaww= spectrometry. Fisher exact tests were used to test for isothiazolinone content and: 1) glue format (2) application purpose and 3) extraction method. Results: Nineteen adhesives (50%) had at least 1 isothiazolinone, and 15 contained 2 isothiazolinones. Frequencies and concentrations were as follows: MI (44.7%; 4–133 ppm), MCI (31.6%; 7–27 ppm), BIT (15.8%; 10–86 ppm), and octylisothiazolinone (2.6%; 1 ppm). Butyl BIT was not detected in any of the adhesives. Format (stick vs liquid) was not statistically associated with isothiazolinone presence. At least half of adhesives in the following application purposes had at least 1 isothiazolinone: shoe, craft, fabric, and school. All-purpose glues had a statistically significant lower concentration of MI and MCI, whereas craft glues were associated with higher concentrations of MI and MCI. Compared with other glues, fabric adhesives were associated with a higher risk of containing BIT.
    [Show full text]
  • Assessment Report
    Regulation (EU) No 528/2012 concerning the making available on the market and use of biocidal products Evaluation of active substances Assessment Report OIT Product-type 08 (Wood preservative) January 2017 UK OIT Product-type 8 January 2017 CONTENTS 1. STATEMENT OF SUBJECT MATTER AND PURPOSE ............................................... 3 1.1. Procedure followed .............................................................................................................................. 3 1.2. Purpose of the assessment report ................................................................................................ 3 2. OVERALL SUMMARY AND CONCLUSIONS ................................................................... 3 2.1. Presentation of the Active Substance ......................................................................................... 3 2.1.1. Identity, Physico-Chemical Properties & Methods of Analysis ................................................... 3 2.1.2. Intended Uses and Efficacy ..................................................................................................................... 4 2.1.3. Classification and Labelling ..................................................................................................................... 4 2.1.3.1. Current active substance classification ...................................................................................... 4 2.1.3.2. Proposed active substance classification ..................................................................................
    [Show full text]
  • CIR EXPERT PANEL MEETING JUNE 8-9, 2020 Distributed for Comment Only -- Do Not Cite Or Quote
    Data Supplement MI CIR EXPERT PANEL MEETING JUNE 8-9, 2020 Distributed for Comment Only -- Do Not Cite or Quote Commitment & Credibility since 1976 Memorandum To: Expert Panel for Cosmetic Ingredient Safety Members and Liaisons From: Jinqiu Zhu, PhD, DABT, ERT, Toxicologist, CIR Christina L. Burnett, Senior Scientific Writer/Analyst, CIR Date: May 29, 2020 Subject: Draft Amended Safety Assessment on Methylisothiazolinone – Wave 3 Since the Draft Amended Safety Assessment on Methylisothiazolinone (MI) was prepared by CIR staff, the US Environmental Protection Agency (EPA) has released a draft risk assessment for Methylchloroisothiazolinone (MCI) and MI,1 and a hazard characterization of isothiazolinones2 (MI062020wave3_epa1 and MI062020wave3_epa2, respectively). The documents have been reviewed by CIR staff and the following notes have been prepared for the Panel’s review. 1. The Panel reopened MI based, in-part, upon the adverse effects on the inhalation of humidifier disinfectants containing MCI/MI. The following summaries of inhalation data from the EPA reports are relatively new:1 • Residential and occupational handler risks were assessed using the MI maximum application rate of 400 ppm by weight. The inhalation margins of exposure (MOEs) for residential aerosol exposures range from 15 to 14,000 and are not of concern because they are greater than the level of concern (LOC) of 10. The inhalation MOE of 1.0 for the residential handler applying paint, however, is of toxicological concern (Table 20 in MI062020wave3_epa1). The MOE for post application exposure to the MI vapors is 1.9 on the day after painting and is of concern; the exposures to the paint vapors decline over time, and, by day 12 after painting, the MOE is 11 which is not of concern (Table 21 in MI062020wave3_epa1).
    [Show full text]
  • Mesures De Maîtrise De La Brucellose Chez Les Bouquetins Du Bargy
    Méthylisothiazolinone dansMesures les produits de maîtrise à usage courantde la brucellose et risques chezassociés lesde sensibilisation bouquetins du Bargy cutanée et respiratoire Avis de l’Anses Rapport d’expertise collective FévrierJuillet 2015 2016 Édition scientifique Méthylisothiazolinone dans les produits à usage courant et risques associés de sensibilisation cutanée et respiratoire Avis de l’Anses Rapport d’expertise collective FévrierJuillet 2015 2016 Édition scientifique Avis de l’Anses Autosaisine n° 2014-SA-0186 La direction générale Maisons-Alfort, le 9 février 2016 AVIS de l’Agence nationale de sécurité sanitaire de l’alimentation, de l’environnement et du travail relatif aux usages de la méthylisothiazolinone (MIT) dans les produits à usage courant et aux risques associés de sensibilisations cutanée et respiratoire L’Anses met en œuvre une expertise scientifique indépendante et pluraliste. L’Anses contribue principalement à assurer la sécurité sanitaire dans les domaines de l’environnement, du travail et de l’alimentation et à évaluer les risques sanitaires qu’ils peuvent comporter. Elle contribue également à assurer d’une part la protection de la santé et du bien-être des animaux et de la santé des végétaux et d’autre part l’évaluation des propriétés nutritionnelles des aliments. Elle fournit aux autorités compétentes toutes les informations sur ces risques ainsi que l’expertise et l’appui scientifique technique nécessaires à l’élaboration des dispositions législatives et réglementaires et à la mise en œuvre des mesures de gestion du risque (article L.1313-1 du code de la santé publique). Ses avis sont rendus publics. L’Anses s’est autosaisie le 11 août 2014 pour la réalisation de l’expertise suivante : état des lieux sur les usages de la méthylisothiazolinone (MIT) dans les produits à usage courant et les risques associés de sensibilisations cutanée et respiratoire.
    [Show full text]
  • NAFTA Technical Working Group on Pesticides Quantitative Structure Activity Relationship Guidance Document
    TECHNICAL WORKING GROUP ON PESTICIDES (TWG) (Q)UANTITATIVE STRUCTURE ACTIVITY RELATIONSHIP NAFTA [(Q)SAR] GUIDANCE DOCUMENT Page 1 of 186 North American Free Trade Agreement (NAFTA) Technical Working Group on Pesticides (TWG) (Quantitative) Structure Activity Relationship [(Q)SAR] Guidance Document November, 2012 Contributors Mary Manibusan, US EPA Joel Paterson, PMRA Dr. Ray Kent, US EPA Dr. Jonathan Chen, US EPA Dr. Jenny Tao, US EPA Dr. Edward Scollon, US EPA Christine Olinger, US EPA Dr. Patricia Schmieder, US EPA Dr. Chris Russom, US EPA Dr. Kelly Mayo, US EPA Dr. Yin-tak Woo, US EPA Dr. Thomas Steeger, US EPA Dr. Edwin Matthews, US FDA Dr. Sunil Kulkarni, Health Canada External Peer Reviewers Kirk Arvidson, US FDA Mark Bonnell, Environment Canada Bob Diderich, OECD Terry Schultz, OECD Andrew Worth, European Commission – Joint Research Centre Page 2 of 186 PREFACE Integrated Approaches to Testing and Assessment (IATA) and (Q)SAR Pesticide regulatory agencies have traditionally relied on extensive in vivo and in vitro testing to support regulatory decisions on human health and environmental risks. While this approach has provided strong support for risk management decisions, there is a clear recognition that it can often require a large number of laboratory animal studies which can consume significant amounts of resources in terms of time for testing and evaluation. Even with the significant amounts of information from standard in vivo and in vitro testing, pesticide regulators are often faced with questions and issues relating to modes of action for toxicity, novel toxicities, susceptible populations, and other factors that can be challenging to address using traditional approaches.
    [Show full text]
  • Dictionary of Contact Allergens: Chemical Structures, Sources And
    51_943_1106* 05.11.2005 12:17 Uhr Seite 943 Chapter 51 Dictionary of Contact Allergens: 51 Chemical Structures, Sources and References Christophe J. Le Coz, Jean-Pierre Lepoittevin 51.1 Introduction This chapter has been written in order to familiarize the reader with the chemical structure of chemicals implicated in contact dermatitis, mainly as haptens respon- sible for allergic contact dermatitis. For each molecule, the principal name is used for classification. We have also listed the most important synonym(s), the Chemical Abstract Service (CAS) Registry Number that characterizes the substance, and its chemical structure. The reader will find one or more relevant literature references. As it was not possible to be exhaustive, some allergens have been omitted since they were obsolete, extremely rarely implicated in contact dermatitis, their case reports were too imprecise or they are extensively treated in other chapters of the textbook. From a practical chemical point of view, acrylates, cyanoacrylates and (meth)acry- lates, cephalosporins, and parabens have been grouped together. 1. Abietic acid CAS Registry Number [514–10–3] Abietic acid is probably the major allergen of colophony, along with dehydroabietic acid,by way of oxidation products.Its detection in a material indicates that allergen- ic components of colophony are present. Suggested Reading Bergh M, Menné T, Karlberg AT (1994) Colophony in paper-based surgical clothing. Contact Der- matitis 31 : 332–333 Karlberg AT, Bergstedt E, Boman A, Bohlinder K, Lidén C, Nilsson JLG,Wahlberg JE (1985) Is abiet- ic acid the allergenic component of colophony? Contact Dermatitis 13 : 209–215 Karlberg AT, Bohlinder K, Boman A, Hacksell U, Hermansson J, Jacobsson S, Nilsson JLG (1988) Identification of 15-hydroperoxyabietic acid as a contact allergen in Portuguese colophony.
    [Show full text]
  • Simultaneous Quantitative Analysis of Six Isothiazolinones in Water
    molecules Article Simultaneous Quantitative Analysis of Six Isothiazolinones in Water-Based Adhesive Used for Food Contact Materials by High-Performance Liquid Chromatography–Tandem Mass Spectrometry (HPLC–MS/MS) Huaining Zhong 1,2, Zicheng Li 1,2, Sheng Chen 1,2, Ying Zeng 1,2, Jianguo Zheng 1,2,*, You Zeng 3 and Dan Li 1,2 1 Guangdong Provincial Key Laboratory of import and export technical measures of animal, plant and food, Guangzhou 510623, China; [email protected] (H.Z.); [email protected] (Z.L.); [email protected] (S.C.); [email protected] (Y.Z.); [email protected] (D.L.) 2 Guangzhou Customs District Technology Center, Guangzhou 510623, China 3 Guangzhou Institute for Food Inspection, Guangzhou 511400, China; [email protected] * Correspondence: [email protected]; Tel.: +8620-3829-0382 Academic Editor: Mihai Brebu Received: 3 September 2019; Accepted: 22 October 2019; Published: 29 October 2019 Abstract: In this study, a target analytical approach using high-performance liquid chromatography–tandem mass spectrometry (HPLC–MS/MS) was developed to simultaneously determine six isothiazolinones containing 2-Methylisothiazol-3(2H)-one (MI), 5-Chloro-2-methyl- 4-isothiazolin-3-one (CMI), 1,2-benzisothiazolin-3-one (BIT), 2-Octyl-3(2H)-isothiazolinone (OIT), Dichlorooctylisothiazolinone (DCOIT), and 2-methyl-1,2-benzisothiazolin-3-one (MBIT) in water-based adhesive used for food contact materials. The main factors affecting extraction efficiency such as extraction method, extraction time, extraction solvent, and solid–liquid ratio have been evaluated by using real adhesive samples. Multiple-reaction monitoring (MRM) was used for the qualitative and quantitative analyses of targeted isothiazolinones.
    [Show full text]
  • Industrial Chemicals, Ashfords Dictionary, Chemical Name Index
    2 Chemical name index A A ACA 4-AA ACA AA ACAC AA acamprosate calcium AAA acarbose AABA ACB AADMC 7-ACCA AAEM ACE AAMX acebutolol AAOA aceclidine AAOC aceclofenac AAOT acemetacin AAPP acenaphthene AAPT acenocoumarol 4-ABA acephate ABA acepromazine abacavir acequinocyl ABAH acesulfame-K abamectin acetaldehyde ABFA acetaldehyde ethyl phenethyl diacetal ABL acetaldehyde oxime ABPA acetaldehyde n-propyl phenethyl diacetal ABS acetaldoxime ABS acetal resins O-ABTF acetal resins P-ABTF acetamide ACN acetamidine hydrochloride 7-ACA 5-acetamido-2-aminobenzenesulfonic acid 7-ANCA 6-acetamido-2-aminophenol-4-sulfonic acid Name Index: Ashford’s Dictionary of Industrial Chemicals 3-acetamidoaniline 3-acetamidoaniline acetic acid, s-butyl ester 4-acetamidoaniline acetic acid, calcium salt p-acetamidoanisole acetic acid, chromium salt 4-acetamidobenzenesulfonyl chloride acetic acid, cinnamyl ester 2-acetamidocinnamic acid acetic acid, citronellyl ester 3-acetamido-2-hydroxyaniline-5-sulfonic acid acetic acid, cobalt salt 1-acetamido-7-hydroxynaphthalene acetic acid, decahydro-β-naphthyl ester 8-acetamido-1-hydroxynaphthalene-3,6-disulfonic acid acetic acid, dicyclopentenyl ester 1-acetamido-7-naphthol acetic acid, diethylene glycol monobutyl ether ester 4-acetamidonitrobenzene acetic acid, 2-ethoxyethyl ester p-acetamidophenol acetic acid, ethoxypropyl ester 3-acetamidopropylsulfonic acid, calcium salt acetic acid, ethyl diglycol ester 5-acetamido-2,4,6-triiodo-N-methylisophthalamic acid acetic acid, ethylene glycol diester 4-acetamido-2-ethoxybenzoic
    [Show full text]