1.0 2016-06-03 10:02:35 UTC 2026-08-19 04:14:39 UTC 2,2'-dithiodi(benzoic acid) SmallMolecule 2,2'-dithiodi(benzoic acid) is an organic compound with the chemical formula C14H10O4S2 and an average molecular weight of 306.35 g/mol. 2,2'-dithiodi(benzoic acid) belongs to the benzoic acids and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. This compound is found in or released from six recorded sources. These include electrical and electronic equipment, specifically conductors or conductive bodies characterized by the conductive materials and electrodes. It is also associated with food, food processing and cookware, including the preparation of wine or sparkling wine and fermentation processes for beer. Additionally, it has been identified in drinking water and water supply, as well as in household cleaning and consumer products, specifically perfumes within detergents and soaps. The recorded exposure route for this substance is oral. C14H10O4S2 306.35 306.00205115 2-[(2-carboxyphenyl)disulfanyl]benzoic acid benzoic acid, 2,2'-dithiobis- 119-80-2 OC(=O)C1=CC=CC=C1SSC1=CC=CC=C1C(O)=O InChI=1S/C14H10O4S2/c15-13(16)9-5-1-3-7-11(9)19-20-12-8-4-2-6-10(12)14(17)18/h1-8H,(H,15,16)(H,17,18) LBEMXJWGHIEXRA-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives O-sulfanylbenzoic acids Benzoic acids Benzoyl derivatives Carboxylic acids Dicarboxylic acids and derivatives Hydrocarbon derivatives Organic disulfides Organic oxides Organooxygen compounds Sulfenyl compounds Aromatic homomonocyclic compound Benzoic acid Benzoyl Carboxylic acid Carboxylic acid derivative Dicarboxylic acid or derivatives Hydrocarbon derivative O-sulfanylbenzoic acid Organic disulfide Organic oxide Organic oxygen compound Organooxygen compound Organosulfur compound Sulfenyl compound Aromatic homomonocyclic compounds Detected and Not Quantified logp 3.1 logp 3.01 ALOGPS logs -3.82 ALOGPS solubility 4.65e-02 g/l ALOGPS logp 3.89 ChemAxon pka_strongest_acidic 2.9 ChemAxon iupac 2-[(2-carboxyphenyl)disulfanyl]benzoic acid ChemAxon average_mass 306.35 ChemAxon mono_mass 306.00205115 ChemAxon smiles OC(=O)C1=CC=CC=C1SSC1=CC=CC=C1C(O)=O ChemAxon formula C14H10O4S2 ChemAxon inchi InChI=1S/C14H10O4S2/c15-13(16)9-5-1-3-7-11(9)19-20-12-8-4-2-6-10(12)14(17)18/h1-8H,(H,15,16)(H,17,18) ChemAxon inchikey LBEMXJWGHIEXRA-UHFFFAOYSA-N ChemAxon polar_surface_area 74.6 ChemAxon refractivity 76.97 ChemAxon polarizability 27.92 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7225ad46b8> 8409 8102