1.0 2010-04-08 22:04:55 UTC 2025-11-18 22:30:16 UTC FDB001328 (±)-Sulcatol Flavouring ingredient C8H16O 128.212 128.120115134 6-methylhept-5-en-2-ol 6-methyl-5-hepten-2-ol 4630-06-2 CC(O)CCC=C(C)C InChI=1S/C8H16O/c1-7(2)5-4-6-8(3)9/h5,8-9H,4,6H2,1-3H3 OHEFFKYYKJVVOX-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms. Fatty alcohols Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aliphatic acyclic compounds Hydrocarbon derivatives Secondary alcohols Alcohol Aliphatic acyclic compound Fatty alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Secondary alcohol a carbohydrate secondary alcohol logp 2.29 ALOGPS logs -1.25 ALOGPS solubility 7.14e+00 g/l ALOGPS logp 1.99 ChemAxon pka_strongest_acidic 17.8 ChemAxon pka_strongest_basic -1.6 ChemAxon iupac 6-methylhept-5-en-2-ol ChemAxon average_mass 128.212 ChemAxon mono_mass 128.120115134 ChemAxon smiles CC(O)CCC=C(C)C ChemAxon formula C8H16O ChemAxon inchi InChI=1S/C8H16O/c1-7(2)5-4-6-8(3)9/h5,8-9H,4,6H2,1-3H3 ChemAxon inchikey OHEFFKYYKJVVOX-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 41.15 ChemAxon polarizability 16.19 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 3801 Specdb::MsIr 3802 Specdb::MsIr 3803 Specdb::CMs 18754 Specdb::CMs 41703 Specdb::CMs 150677 Specdb::NmrOneD 160550 Specdb::NmrOneD 160551 Specdb::NmrOneD 160552 Specdb::NmrOneD 160553 Specdb::NmrOneD 160554 Specdb::NmrOneD 160555 Specdb::NmrOneD 160556 Specdb::NmrOneD 160557 Specdb::NmrOneD 160558 Specdb::NmrOneD 160559 Specdb::NmrOneD 160560 Specdb::NmrOneD 160561 Specdb::NmrOneD 160562 Specdb::NmrOneD 160563 Specdb::NmrOneD 160564 Specdb::NmrOneD 160565 Specdb::NmrOneD 160566 Specdb::NmrOneD 160567 Specdb::NmrOneD 160568 Specdb::MsMs 90234 Specdb::MsMs 90235 Specdb::MsMs 90236 Specdb::MsMs 153339 Specdb::MsMs 153340 Specdb::MsMs 153341 Specdb::MsMs 2237791 Specdb::MsMs 2674669 Specdb::MsMs 2674670 Specdb::MsMs 2674671 Specdb::MsMs 3034448 Specdb::MsMs 3034449 Specdb::MsMs 3034450 HMDB0030030