1.0 2010-04-08 22:12:31 UTC 2019-11-26 03:13:29 UTC FDB016572 Ethyl (E)-2-octenoate Flavouring agent (e)-Ethyl 2-octenoate (E)-Oct-2-enoic acid ethyl ester 2-Octenoic acid, ethyl ester 2-Octenoic acid, ethyl ester, (E)- Ethyl (2E)-2-octenoate Ethyl (E)-2-octenoate Ethyl (E)-oct-2-enoate Ethyl 2-octenoate Ethyl 2-octenoate, (E)- Ethyl 2-octenoate, trans- Ethyl ester(e)-2-octenoic acid Ethyl oct-2-enoate Ethyl trans-2-octenoate Ethyl-trans-2-octenoate FEMA 3344? trans-2-Octenoic acid ethyl ester trans-2-Octenoic acid, ethyl ester trans-Ethyl 2-octenoate C10H18O2 170.2487 170.13067982 ethyl (2Z)-oct-2-enoate ethyl (2Z)-oct-2-enoate 7367-82-0 CCCCC\C=C/C(=O)OCC InChI=1S/C10H18O2/c1-3-5-6-7-8-9-10(11)12-4-2/h8-9H,3-7H2,1-2H3/b9-8- AISZSTYLOVXFII-HJWRWDBZSA-N belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. Fatty acid esters Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acid esters Aliphatic acyclic compounds Carbonyl compounds Enoate esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic acyclic compound Alpha,beta-unsaturated carboxylic ester Carbonyl group Carboxylic acid derivative Carboxylic acid ester Enoate ester Fatty acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound logp 3.71 ALOGPS logs -3.23 ALOGPS solubility 1.01e-01 g/l ALOGPS logp 3.43 ChemAxon pka_strongest_basic -6.8 ChemAxon iupac ethyl (2Z)-oct-2-enoate ChemAxon average_mass 170.2487 ChemAxon mono_mass 170.13067982 ChemAxon smiles CCCCC\C=C/C(=O)OCC ChemAxon formula C10H18O2 ChemAxon inchi InChI=1S/C10H18O2/c1-3-5-6-7-8-9-10(11)12-4-2/h8-9H,3-7H2,1-2H3/b9-8- ChemAxon inchikey AISZSTYLOVXFII-HJWRWDBZSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 50.89 ChemAxon polarizability 20.17 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17898 Specdb::CMs 158579 Specdb::MsIr 7542 Specdb::MsIr 7543 Specdb::MsMs 305641 Specdb::MsMs 305642 Specdb::MsMs 305643 Specdb::MsMs 349087 Specdb::MsMs 349088 Specdb::MsMs 349089 Specdb::MsMs 2323012 Specdb::MsMs 2323013 Specdb::MsMs 2323014 Specdb::MsMs 2616438 Specdb::MsMs 2616439 Specdb::MsMs 2616440 HMDB37497 #<Reference:0x000055ce3079e5d8> Asian pear Type 1 specific Pyrus pyrifolia 3767 Pear Type 1 specific Pyrus communis 23211 fatty fruity green pear skin plum skin tropical waxy