1.0 2010-04-08 22:05:35 UTC 2019-11-26 02:58:13 UTC FDB002953 (3xi,5Z)-1,5-Octadien-3-ol Off-flavour component of cooked prawns and sand-lobsters. (3xi,5Z)-1,5-Octadien-3-ol is found in crustaceans. (5Z)-1,5-octadien-3-ol (Z)-1,5-octadien-3-ol 1,5-Octadien-3-ol, (Z)- 1,5Z-Octadien-3R-ol Octa-1,5-dien-3-ol Z-1,5-Octadien-3-ol C8H14O 126.1962 126.10446507 (5E)-octa-1,5-dien-3-ol (5E)-octa-1,5-dien-3-ol 50306-18-8 CC\C=C\CC(O)C=C InChI=1S/C8H14O/c1-3-5-6-7-8(9)4-2/h4-6,8-9H,2-3,7H2,1H3/b6-5+ APFBWMGEGSELQP-AATRIKPKSA-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 Fatty alcohols logp 2.39 ALOGPS logs -1.91 ALOGPS solubility 1.54e+00 g/l ALOGPS logp 2.12 ChemAxon pka_strongest_acidic 17.44 ChemAxon pka_strongest_basic -1.7 ChemAxon iupac (5E)-octa-1,5-dien-3-ol ChemAxon average_mass 126.1962 ChemAxon mono_mass 126.10446507 ChemAxon smiles CC\C=C\CC(O)C=C ChemAxon formula C8H14O ChemAxon inchi InChI=1S/C8H14O/c1-3-5-6-7-8(9)4-2/h4-6,8-9H,2-3,7H2,1H3/b6-5+ ChemAxon inchikey APFBWMGEGSELQP-AATRIKPKSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 41.29 ChemAxon polarizability 15.49 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16554 Specdb::CMs 42276 Specdb::CMs 155733 Specdb::MsIr 4044 Specdb::MsIr 4045 Specdb::MsIr 4046 Specdb::NmrOneD 162469 Specdb::NmrOneD 162470 Specdb::NmrOneD 162471 Specdb::NmrOneD 162472 Specdb::NmrOneD 162473 Specdb::NmrOneD 162474 Specdb::NmrOneD 162475 Specdb::NmrOneD 162476 Specdb::NmrOneD 162477 Specdb::NmrOneD 162478 Specdb::NmrOneD 162479 Specdb::NmrOneD 162480 Specdb::NmrOneD 162481 Specdb::NmrOneD 162482 Specdb::NmrOneD 162483 Specdb::NmrOneD 162484 Specdb::NmrOneD 162485 Specdb::NmrOneD 162486 Specdb::NmrOneD 162487 Specdb::NmrOneD 162488 Specdb::MsMs 97323 Specdb::MsMs 97324 Specdb::MsMs 97325 Specdb::MsMs 162018 Specdb::MsMs 162019 Specdb::MsMs 162020 Specdb::MsMs 2787616 Specdb::MsMs 2787617 Specdb::MsMs 2787618 Specdb::MsMs 2917949 Specdb::MsMs 2917950 Specdb::MsMs 2917951 HMDB30966 #<Reference:0x000055ce325163e0> Crustaceans Unknown generic 6657 earthy