1.0 2010-04-08 22:14:37 UTC 2019-11-26 03:17:55 UTC FDB019851 (R)-3-Mercaptohexanol Constituent of volatile oil of yellow passion fruit (Passiflora edulis f. flavicarpa). (R)-3-Mercaptohexanol is found in fruits. (R)-3-Mercapto-1-hexanol (R)-3-Mercaptohexanol C6H14OS 134.24 134.07653576 (3R)-3-sulfanylhexan-1-ol (3R)-3-sulfanylhexan-1-ol 90180-88-4 CCCC(S)CCO InChI=1S/C6H14OS/c1-2-3-6(8)4-5-7/h6-8H,2-5H2,1H3 TYZFMFVWHZKYSE-UHFFFAOYSA-N belongs to the class of organic compounds known as alkylthiols. These are organic compounds containing the thiol functional group linked to an alkyl chain. Alkylthiols Organic compounds Organosulfur compounds Thiols Alkylthiols Aliphatic acyclic compounds Hydrocarbon derivatives Primary alcohols Alcohol Aliphatic acyclic compound Alkylthiol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol logp 1.38 ChemAxon pka_strongest_acidic 10.05 ChemAxon pka_strongest_basic -2.4 ChemAxon iupac (3R)-3-sulfanylhexan-1-ol ChemAxon average_mass 134.24 ChemAxon mono_mass 134.07653576 ChemAxon smiles CCCC(S)CCO ChemAxon formula C6H14OS ChemAxon inchi InChI=1S/C6H14OS/c1-2-3-6(8)4-5-7/h6-8H,2-5H2,1H3 ChemAxon inchikey TYZFMFVWHZKYSE-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 39.04 ChemAxon polarizability 15.96 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Fruits Unknown generic