1.0 2010-04-08 22:06:44 UTC 2025-11-18 22:59:26 UTC FDB005545 7-Octen-4-ol 7-octen-4-ol is a member of the class of compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). 7-octen-4-ol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). 7-octen-4-ol can be found in soy bean, which makes 7-octen-4-ol a potential biomarker for the consumption of this food product. C8H16O 128.212 128.120115134 oct-7-en-4-ol oct-7-en-4-ol CCCC(O)CCC=C InChI=1S/C8H16O/c1-3-5-7-8(9)6-4-2/h3,8-9H,1,4-7H2,2H3 MJWKMORBWQZWOT-UHFFFAOYSA-N belongs to the class of organic compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). Secondary alcohols Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Aliphatic acyclic compounds Hydrocarbon derivatives Aliphatic acyclic compound Hydrocarbon derivative Secondary alcohol logp 2.45 ALOGPS logs -1.76 ALOGPS solubility 2.23e+00 g/l ALOGPS logp 2.33 ChemAxon pka_strongest_acidic 18.62 ChemAxon pka_strongest_basic -1.2 ChemAxon iupac oct-7-en-4-ol ChemAxon average_mass 128.212 ChemAxon mono_mass 128.120115134 ChemAxon smiles CCCC(O)CCC=C ChemAxon formula C8H16O ChemAxon inchi InChI=1S/C8H16O/c1-3-5-7-8(9)6-4-2/h3,8-9H,1,4-7H2,2H3 ChemAxon inchikey MJWKMORBWQZWOT-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 40.32 ChemAxon polarizability 16.3 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 99756 Specdb::MsMs 99757 Specdb::MsMs 99758 Specdb::MsMs 164940 Specdb::MsMs 164941 Specdb::MsMs 164942 Specdb::MsMs 3601898 Specdb::MsMs 3601899 Specdb::MsMs 3601900 Specdb::MsMs 3601901 Specdb::MsMs 3601902 Specdb::MsMs 3601903 Soy bean Type 1 specific Glycine max 3847