1.0 2016-05-19 02:39:28 UTC 2026-08-24 02:23:06 UTC 2,4,6-Trichloroanisole SmallMolecule 2,4,6-Trichloroanisole is an organic compound with the formula C7H5Cl3O and an average molecular weight of 211.47 g/mol. 2,4,6-Trichloroanisole belongs to the anisoles, a subclass of phenol ethers within the organic compounds. This benzenoid compound is present in polyethylene terephthalate plastics. The compound is found in or released from 30 recorded sources. Within the category of electrical and electronic equipment, these include communication cables or conductors, adjustable resistors, antennas, auxiliary devices, and conductors or conductive bodies characterised by the conductive materials, among 10 others. In household cleaning and consumer products, it is associated with bleaching agents, cigar cigarettes, non electric simulated smoking devices, pipe accessories, and perfumes within detergents and soaps, among two more. Sources related to food, food processing, and cookware include food preservation, food contact materials, fermentation processes for beer, and the preparation of wine or sparkling wine. Additionally, it is found in drinking water and water supply, as well as building and construction materials such as ceilings, floors, tents, or canopies. Recorded exposure routes for 2,4,6-Trichloroanisole include inhalation, oral, and touch. 1,3,5-Trichloro-2-methoxybenzene C7H5Cl3O 211.473 209.940597903 1,3,5-trichloro-2-methoxybenzene tyrene 87-40-1 COC1=C(Cl)C=C(Cl)C=C1Cl InChI=1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3 WCVOGSZTONGSQY-UHFFFAOYSA-N Organic compounds Benzenoids Phenol ethers Anisoles Anisoles Alkyl aryl ethers Aryl chlorides Chlorobenzenes Hydrocarbon derivatives Methoxybenzenes Organochlorides Phenoxy compounds Alkyl aryl ether Anisole Aromatic homomonocyclic compound Aryl chloride Aryl halide Chlorobenzene Ether Halobenzene Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Organic oxygen compound Organochloride Organohalogen compound Organooxygen compound Phenoxy compound Aromatic homomonocyclic compounds a small molecule monomethoxybenzene trichlorobenzene Detected and Not Quantified logp 4 logp 4.00 ALOGPS logs -3.95 ALOGPS solubility 2.36e-02 g/l ALOGPS logp 3.63 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac 1,3,5-trichloro-2-methoxybenzene ChemAxon average_mass 211.473 ChemAxon mono_mass 209.940597903 ChemAxon smiles COC1=C(Cl)C=C(Cl)C=C1Cl ChemAxon formula C7H5Cl3O ChemAxon inchi InChI=1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3 ChemAxon inchikey WCVOGSZTONGSQY-UHFFFAOYSA-N ChemAxon polar_surface_area 9.23 ChemAxon refractivity 46.94 ChemAxon polarizability 18.31 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7261731420> 6884 6620