1.0 2010-04-08 22:15:34 UTC 2018-05-29 01:50:14 UTC FDB021237 Cinnamyl isovalerate It is used in food flavouring (2E)-3-Phenyl-2-propenyl 3-methylbutanoate 3-Methylbutanoic acid 3-phenyl-2-propenyl ester 3-Phenyl-2-propenyl 3-methylbutanoate 3-Phenylallyl 3-methylbutanoate 3-Phenylallyl isovalerate Butanoic acid, 3-methyl-, 3-phenyl-2-propen-1-yl ester Butanoic acid, 3-methyl-, 3-phenyl-2-propenyl ester Cinnamyl 3-methyl butyrate Cinnamyl 3-methylbutanoate Cinnamyl isovalerate Cinnamyl isovalerianate FEMA 2302 Isovaleric acid, cinnamyl ester Isovaleric acid, cinnamyl ester (6CI,7CI,8CI) Trans-cinnamyl isovalerate C14H18O2 218.2915 218.13067982 (2Z)-3-phenylprop-2-en-1-yl 3-methylbutanoate (2Z)-3-phenylprop-2-en-1-yl 3-methylbutanoate 140-27-2 CC(C)CC(=O)OC\C=C/C1=CC=CC=C1 InChI=1S/C14H18O2/c1-12(2)11-14(15)16-10-6-9-13-7-4-3-5-8-13/h3-9,12H,10-11H2,1-2H3/b9-6- FOCMOGKCPPTERB-TWGQIWQCSA-N belongs to the class of organic compounds known as styrenes. These are organic compounds containing an ethenylbenzene moiety. Styrenes Organic compounds Benzenoids Benzene and substituted derivatives Styrenes Aromatic homomonocyclic compounds Carbonyl compounds Carboxylic acid esters Fatty acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aromatic homomonocyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty acid ester Fatty acyl Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Styrene logp 4.31 ALOGPS logs -4.16 ALOGPS solubility 1.52e-02 g/l ALOGPS logp 3.69 ChemAxon pka_strongest_basic -7 ChemAxon iupac (2Z)-3-phenylprop-2-en-1-yl 3-methylbutanoate ChemAxon average_mass 218.2915 ChemAxon mono_mass 218.13067982 ChemAxon smiles CC(C)CC(=O)OC\C=C/C1=CC=CC=C1 ChemAxon formula C14H18O2 ChemAxon inchi InChI=1S/C14H18O2/c1-12(2)11-14(15)16-10-6-9-13-7-4-3-5-8-13/h3-9,12H,10-11H2,1-2H3/b9-6- ChemAxon inchikey FOCMOGKCPPTERB-TWGQIWQCSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 66.12 ChemAxon polarizability 25.39 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20637 Specdb::CMs 152151 Specdb::MsMs 311965 Specdb::MsMs 311966 Specdb::MsMs 311967 Specdb::MsMs 357088 Specdb::MsMs 357089 Specdb::MsMs 357090 Specdb::MsMs 2377891 Specdb::MsMs 2377892 Specdb::MsMs 2377893 Specdb::MsMs 2557131 Specdb::MsMs 2557132 Specdb::MsMs 2557133 HMDB41318 #<Reference:0x000055ce330964e0> apple cherry green melon spice sweet