1.0 2010-04-08 22:08:38 UTC 2018-05-28 23:24:26 UTC FDB009570 3-Hexenyl 2-methylbutyrate It is used as a food additive . 3-Hexenyl 2-methylbutanoate Butanoic acid, 2-methyl-, 3-hexen-1-yl ester Butanoic acid, 2-methyl-, 3-hexenyl ester Butyric acid, 2-methyl-, 3-hexenyl ester Hex-3-enyl 2-methylbutanoate Hex-3-enyl 2-methylbutyrate C11H20O2 184.2753 184.146329884 hex-3-en-1-yl 2-methylbutanoate hex-3-en-1-yl 2-methylbutanoate 10094-41-4 CCC=CCCOC(=O)C(C)CC InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h6-7,10H,4-5,8-9H2,1-3H3 JKKGTSUICJWEKB-UHFFFAOYSA-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 Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound logp 3.71 ALOGPS logs -3.11 ALOGPS solubility 1.43e-01 g/l ALOGPS logp 3.46 ChemAxon pka_strongest_basic -7.1 ChemAxon iupac hex-3-en-1-yl 2-methylbutanoate ChemAxon average_mass 184.2753 ChemAxon mono_mass 184.146329884 ChemAxon smiles CCC=CCCOC(=O)C(C)CC ChemAxon formula C11H20O2 ChemAxon inchi InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h6-7,10H,4-5,8-9H2,1-3H3 ChemAxon inchikey JKKGTSUICJWEKB-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 55.41 ChemAxon polarizability 22.28 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25539 Specdb::CMs 171754 Specdb::MsMs 63030 Specdb::MsMs 63031 Specdb::MsMs 63032 Specdb::MsMs 119898 Specdb::MsMs 119899 Specdb::MsMs 119900 Specdb::MsMs 2388338 Specdb::MsMs 2388339 Specdb::MsMs 2388340 Specdb::MsMs 2574004 Specdb::MsMs 2574005 Specdb::MsMs 2574006 HMDB32320 #<Reference:0x000055ce330a6ea8> apple fresh fruity green herbal pineapple sweet warm