CAS Chem.name Chem.SMILES #CA_without_S9 #Obs_CA_with_S9 Bioassay - Reference(s) - 87-29-6 Cinnamyl Anthranilate Nc1ccccc1C(=O)OCC=Cc1ccccc1 negative negative in Vitro Mammalian Chromosome Aberration Test Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan 97-88-1 Butyl Metbacrylate CCCCOC(=O)C(C)=C negative negative in Vitro Mammalian Chromosome Aberration Test NIHS Japan 11042-64-1 gamma-Oryzanol CC(CCC=C(C)C)C1CCC2(C)C3CCC4C(C)(C)C(OC(=O)C=Cc5ccc(O)c(OC)c5)CCC44CC34CCC12C negative negative in Vitro Mammalian Chromosome Aberration Test Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan 688-84-6 2-propenoic_acid,_2-methyl-,_2-ethylhexyl_ester CCCCC(CC)COC(=O)C(C)=C negative negative in Vitro Mammalian Chromosome Aberration Test NIHS Japan 105-16-8 2-propenoic_acid,_2-methyl-,_2-(diethylamino)ethyl_ester CCN(CC)CCOC(=O)C(C)=C negative positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 23246-96-0 Riddelliine CC=C1CC(=C)C(O)(CO)C(=O)OCC2=CCN3CCC(C23)OC1=O negative positive in Vitro Mammalian Chromosome Aberration Test GALLOWAY,SM, ARMSTRONG, MJ, REUBEN,C, COLMAN,S BROWN,B, CANNON,C, BLOOM,A.D, NAKAMURA,F, AHMED,M. DUK,S, RIMPO,J, MARGOLIN,BH, RESNICK,MA, ANDERSON,B AND ZEIGER,E; CHROMOSOME ABERRATIONS AND SISTER CHROMATID EXCHANGES IN CHINESE HAMSTER OVARY CELLS: EVALUATIONS OF 108 CHEMICALS; ENVIRON. MOL. MUTAGEN. 10(SUPPL. 10):1-175, 1987 2608-48-2 5-(4-nitrophenyl)-2,4-pentadienal c1(ccc(C=CC=CC=O)cc1)[N+](=O)[O-] negative negative in Vitro Mammalian Chromosome Aberration Test Zeiger, E., Shelby, M.D., Ivett, J., McFee, A.F., Mutagenicity testing of 5-(4-nitrophenyl)-2,4-pentadien-1-al (spy dust) and its metabolites in vitro and in vivo. Environ. Mutagen., 1987, 9(3), 269-280. 39300-45-3 dinocap CC=CC(=O)Oc1c(CCCCCC(C)C)cc(cc1[N+](=O)[O-])[N+](=O)[O-] negative negative in Vitro Mammalian Chromosome Aberration Test Dinocap, Summary of Toxicological Data, California Department of Food and Agriculture Toxicology Branch; http://www.cdpr.ca.gov/docs/risk/toxsums/pdfs/344.pdf 29171-20-8 Dehydrolinalool CC(C)=CCCC(C)(O)C#C negative negative in Vitro Mammalian Chromosome Aberration Test ECHA, Registration dossier. 3,7-Dimethyloct-6-en-1-yn-3-ol CAS No 29171-20-8., Last modified: 2015. https://echa.europa.eu/registration-dossier/-/registered-dossier/12800; OECD/SIDS, Dehydro-beta-linalool CAS No 29171-20-8. Screening Information Data Set (SIDS) of OECD High Production Volume Chemicals Programme, 1994. http://www.inchem.org/pages/sids.html 78-70-6 Linalool CC(C)=CCCC(C)(O)C=C negative negative in Vitro Mammalian Chromosome Aberration Test Belsito, D., Bickers, D., Bruze, M., Calow, P., Greim, H., Hanifin, J.M., Rogers, A.E., Saurat, J.H., Sipes, I.G., Tagami, H., A safety assessment of non-cyclic alcohols with unsaturated branched chain when used as fragrance ingredients: the RIFM expert panel. Food Chem. Toxicol., 2010, 48(3), S1-S42. 96-33-3 Methyl Acrylate COC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan 104-55-2 cinnamaldehyde;_2-Propenal,_3-phenyl- O=CC=Cc1ccccc1 positive positive in Vitro Mammalian Chromosome Aberration Test Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan 106-91-2 Glycidyl methacrylate CC(=C)C(=O)OCC{P-}1CO1 positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 108-31-6 Maleic Anhydride O=C1C=CC(=O)O1 positive positive in Vitro Mammalian Chromosome Aberration Test Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan 140-88-5 Ethyl Acrylate CCOC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan 585-07-9 tert-_Butylmethacrylate CC(=C)C(=O)OC(C)(C)C positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 868-77-9 2-methyl-2-propenoic_acid,_2-hydroxyethyl_ester CC(=C)C(=O)OCCO positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 2439-35-2 2-(dimethylamino)ethyl acrylate CN(C)CCOC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 623-91-6 diethyl_maleate CCOC(=O)C=CC(=O)OCC positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 27813-02-1 methacrylic_acid,_monoester_with_propane-1,2-diol CC(O)COC(=O)C(C)=C positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 2867-47-2 N,N-Dimethylaminoethyl methacrylate CC(=C)C(=O)OCCN(C)C positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 5039-78-1 (2-(Methacryloyloxy)ethyl)trimethylammonium CC(=C)C(=O)OCCN{+}(C)(C)(C).Cl{-} positive positive in Vitro Mammalian Chromosome Aberration Test NIHS Japan 79-10-7 Acrylic_Acid C=CC(O)=O positive positive in Vitro Mammalian Chromosome Aberration Test McCarthy, K.L., Thomas, W.C., Aardema, M.J., Seymour, J.L., Putman, D.L., Yang, L.L., Curren, R.D., Valencia, R., Genetic toxicology of acrylic acid. Food Chem. Toxicol., 1992, 30(6), 505-515. Danish EPA Inventory, Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test In Vitro, Revised Edition. Life-Science Information Center; Tokyo, Japan. 3688-53-7 2-(2-Furyl)-3-(5-Nitro-2-Furyl)Acrylamide; Furylfuramide NC(=O)/C(=C/c1ccc(o1)[N+](=O)[O-])c1ccco1 positive positive in Vitro Mammalian Chromosome Aberration Test U.S.Environmental Protection Agency Gene-Tox Program. Mutation Research, 168, (1986) pp. 69-240 80-62-6 Methyl_Methacrylate CC(=C)C(=O)OC positive positive in Vitro Mammalian Chromosome Aberration Test National Toxicology Program, Technical Report Series No. 314, Toxicology and Carcinogenesis Studies Of Methyl Methacrylate (CASNo. 80-62-6) In F344/N Rats and B6C3FT Mice 97-90-5 Ethylene Methacrylate CC(=C)C(=O)OCCOC(=O)C(C)=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 103-11-7 Ethylhexyl_Acrylate;2- CCCCC(CC)COC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 109-16-0 Triethylene Glycol Dimethacrylate CC(=C)C(=O)OCCOCCOCCOC(=O)C(C)=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 141-32-2 N-Butyl_Acrylate CCCCOC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 2223-82-7 2,2-Dimethyltrimethylene acrylate CC(C)(COC(=O)C=C)COC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 15625-89-5 Acrylic_acid_2,2-bis-acryloyloxymethyl-butyl_ester CCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 999-61-1 propylene glycol monoacrylate CC(O)COC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 1680-21-3 2-propenoic acid, 1,2-ethanediylbis(oxy-2,1-etha C=CC(=O)OCCOCCOCCOC(=O)C=C positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 96-05-9 2-propenoic acid, 2-methyl-, 2-propen-1-yl ester CC(=C)C(=O)OCC=C positive positive in Vitro Mammalian Chromosome Aberration Test Elf Atochem, 1991, Chrmosomal Aberration assay with Allyl Metacrylate using Human Lymphosytes. Report No. CIT 7330. SIAM 10, Screening Information Data Base (SIDS). Available from: http://www.chem.unep/ch/irptc/sids/OECDSIDS/sidspub.html. 68586-19-6 Dicyclopentenyloxyethylmethacrylate CC(=C)C(=O)OCC(OC1CCCC=1)O/C1CCC\C=1 positive positive in Vitro Mammalian Chromosome Aberration Test F. R. Johansen et. al. Regulatory Toxicology and Pharmacology 50 (2008) 322-335. 147783-69-5 Propanedioic acid, 2-((4-methoxyphenyl)methylene)-, 1,3-bis(1,2,2,6,6-pentamethyl-4-piperidinyl) ester CC1(C)CC(OC(=O)C(=Cc2ccc(OC)cc2)C(=O)OC2CC(C)(C)N(C)C(C)(C)C2)CC(C)(C)N1C positive positive in Vitro Mammalian Chromosome Aberration Test VP Sanduvor PR-31, Full Public Report, National Industrial Chemicals Notification and Assessment Scheme (NICNAS) (September 1997); http://www.nicnas.gov.au/__data/assets/pdf_file/0016/9304/NA529FR.PDF. 77439-76-0 3-Chloro-4-(dichloromethyl)-5-hydroxy-2(5H)-furanone OC1C(C(Cl)Cl)=C(Cl)C(=O)O1 positive positive in Vitro Mammalian Chromosome Aberration Test MATSUMURA,H, WATANABE,M, MATSUMOTO,K AND OHTA,T; 3-CHLORO-4-(DICHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE (MX) INDUCES GENE MUTATIONS AND INHIBITS METABOLIC COOPERATION IN CULTURED CHINESE HAMSTER CELLS; J. TOXICOL. ENVIRON. HEALTH 43(1):65-72, 1994 21739-91-3 cytembena [Na]_COc1ccc(C(=O)C(Br)=CC(O)=O)cc1 positive positive in Vitro Mammalian Chromosome Aberration Test IVETT,JL, BROWN,BM, RODGERS,C, ANDERSON,BE, RESNICK,MA AND ZEIGER,E;CHROMOSOMAL ABERRATIONS AND SISTER CHROMATID EXCHANGE TESTS IN CHINESE HAMSTER OVARY CELLS IN VITRO. IV. RESULTS WITH 15 CHEMICALS; ENVIRON. MOL. MUTAGEN. 14(3): 165-187, 1989 818-61-1 2-Hydroxyethyl acrylate C=CC(=O)OCCO positive positive in Vitro Mammalian Chromosome Aberration Test JAPAN CHEMICAL INDUSTRY ECOLOGY-TOXICOLOGY & INFORMATION CENTER (JETOC), JAPAN; MUTAGENICITY TEST DATA OF EXISTING CHEMICAL SUBSTANCES BASED ON THE TOXICITY INVESTIGATION SYSTEM OF THE INDUSTRIAL SAFETY AND HEALTH LAW, SUPPLEMENT 3; 2005 6923-22-4 Monocrotophos CC(=CC(=O)NC)OP(=O)(OC)OC positive positive in Vitro Mammalian Chromosome Aberration Test M.F. Lin, C.L. Wu, T.C. Wang; Pesticide clastogenicity in Chinese hamster ovary cells, Mutat. Res . Volume 188, Issue 3, July 1987, Pages 241–250 107-02-8 Acrolein C=CC=O positive positive in Vitro Mammalian Chromosome Aberration Test Ishidate, M., M. C. Harnois, T. Sofuni, A Comparative Analysis of Data on the Clastogenicity of 951 Chemical Substances Tested in Mammalian Cell Cultures, Mutat. Res. 195 (1988), 151 – 213 4170-30-3 Crotonaldehyde CC=CC=O positive positive in Vitro Mammalian Chromosome Aberration Test Galloway, S.M., Armstrong, M.J., Reuben, C., Colman, S., Brown, B., Cannon, C., Bloom, A.D., Nakamura, F., Ahmed, M., Duk, S., Rimpo, J., Margolin, B.H., Resnick, M.A., Anderson, B., Zeiger, E., Chromosome aberrations and sister chromatid exchanges in Chinese hamster ovary cells: evaluations of 108 chemicals. Environ. Mol. Mutagen., 1987, 10 Suppl. 10, 1-175. 497-03-0 2-Methylcrotonaldehyde CC=C(C)C=O positive positive in Vitro Mammalian Chromosome Aberration Test EFSA Panel on Food Contact Material, Enzymes, Flavourings and Processing Aids (CEF); Scientific Opinion on Flavouring Group Evaluation 201Rev1: 2-Alkylated, aliphatic, acyclic alpha, beta-unsaturated aldehydes and precursors, with or without additional double-bonds, from chemical subgroup 1.1.2 of FGE.19. EFSA J., 2012, 10(5), 2749, [27 pp.]. doi:10.2903/j.efsa.2012.2749