1.0 2010-04-08 22:08:38 UTC 2020-02-24 19:10:58 UTC FDB009547 2-Heptanethiol It is used as a food additive . 2-Heptanethiol is found in green bell pepper. 2-Heptylthiol C7H16S 132.267 132.097271202 heptane-2-thiol heptane-2-thiol 628-00-2 CCCCCC(C)S InChI=1S/C7H16S/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3 DAZNOIJJVKASGS-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 Aliphatic acyclic compound Alkylthiol Hydrocarbon derivative logp 4.17 ALOGPS logs -3.34 ALOGPS solubility 6.11e-02 g/l ALOGPS logp 3.26 ChemAxon pka_strongest_acidic 10.09 ChemAxon pka_strongest_basic -9.7 ChemAxon iupac heptane-2-thiol ChemAxon average_mass 132.267 ChemAxon mono_mass 132.097271202 ChemAxon smiles CCCCCC(C)S ChemAxon formula C7H16S ChemAxon inchi InChI=1S/C7H16S/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3 ChemAxon inchikey DAZNOIJJVKASGS-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 41.83 ChemAxon polarizability 17.06 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 0 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 5249 Specdb::MsIr 5250 Specdb::MsIr 5251 Specdb::CMs 14481 Specdb::CMs 159663 Specdb::MsMs 75369 Specdb::MsMs 75370 Specdb::MsMs 75371 Specdb::MsMs 134997 Specdb::MsMs 134998 Specdb::MsMs 134999 Specdb::MsMs 2303724 Specdb::MsMs 2303725 Specdb::MsMs 2303726 Specdb::MsMs 3065861 Specdb::MsMs 3065862 Specdb::MsMs 3065863 HMDB32303 #<Reference:0x000055ce32ce1318> Green bell pepper Type 1 specific Capsicum annuum 4072 onion pungent skunky sulfurous sweaty vegetable