1.0 2010-04-08 22:14:42 UTC 2019-11-26 03:18:09 UTC FDB019954 1,1'-Thiobisethanethiol Volatile constituent of cooked mutton. 1,1'-Thiobisethanethiol is found in animal foods. Bis(1-mercaptoethyl) sulfide C4H10S3 154.317 153.99446239 1-[(1-sulfanylethyl)sulfanyl]ethane-1-thiol 1-[(1-sulfanylethyl)sulfanyl]ethanethiol 53897-59-9 CC(S)SC(C)S InChI=1S/C4H10S3/c1-3(5)7-4(2)6/h3-6H,1-2H3 PAEMPWLDXSJQRU-UHFFFAOYSA-N belongs to the class of organic compounds known as hemiacetals. Hemiacetals are compounds comprising the hemiacetal functional group, with the general formula R2C(OH)OR' ( R' not Hydrogen ). Hemiacetals Organic compounds Organic oxygen compounds Organooxygen compounds Ethers Aliphatic acyclic compounds Alkylthiols Dialkylthioethers Dithiohemiacetals Hydrocarbon derivatives Sulfenyl compounds Aliphatic acyclic compound Alkylthiol Dialkylthioether Dithiohemiacetal Hemiacetal Hydrocarbon derivative Organosulfur compound Sulfenyl compound Thioether logp 1.85 ALOGPS logs -2.79 ALOGPS solubility 2.52e-01 g/l ALOGPS logp 2.04 ChemAxon pka_strongest_acidic 9.27 ChemAxon iupac 1-[(1-sulfanylethyl)sulfanyl]ethane-1-thiol ChemAxon average_mass 154.317 ChemAxon mono_mass 153.99446239 ChemAxon smiles CC(S)SC(C)S ChemAxon formula C4H10S3 ChemAxon inchi InChI=1S/C4H10S3/c1-3(5)7-4(2)6/h3-6H,1-2H3 ChemAxon inchikey PAEMPWLDXSJQRU-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 43.42 ChemAxon polarizability 16.63 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 0 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10193 Specdb::CMs 135911 Specdb::CMs 143645 Specdb::MsMs 288496 Specdb::MsMs 288497 Specdb::MsMs 288498 Specdb::MsMs 327637 Specdb::MsMs 327638 Specdb::MsMs 327639 Specdb::MsMs 3060484 Specdb::MsMs 3060485 Specdb::MsMs 3060486 Specdb::MsMs 3110198 Specdb::MsMs 3110199 Specdb::MsMs 3110200 HMDB40239 #<Reference:0x000055ce315c5878>