1.0 2010-04-08 22:12:40 UTC 2015-07-20 23:33:05 UTC FDB016829 Isopropyl cinnamate Flavouring ingredient 1-Methylethyl 3-phenylpropenoate Cinnamic acid, isopropyl ester FEMA 2939 Isopropyl (2E)-3-phenyl-2-propenoate Isopropyl 3-phenylpropenoate Isopropyl cinnamate Isopropylester kyseliny skoricove C12H14O2 190.2384 190.099379692 propan-2-yl (2Z)-3-phenylprop-2-enoate isopropyl (2Z)-3-phenylprop-2-enoate 7780-06-5 CC(C)OC(=O)\C=C/C1=CC=CC=C1 InChI=1S/C12H14O2/c1-10(2)14-12(13)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8- RGACABDFLVLVCT-HJWRWDBZSA-N belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid. Cinnamic acid esters Organic compounds Phenylpropanoids and polyketides Cinnamic acids and derivatives Cinnamic acid esters Aromatic homomonocyclic compounds Carbonyl compounds Enoate esters Fatty acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Styrenes Alpha,beta-unsaturated carboxylic ester Aromatic homomonocyclic compound Benzenoid Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cinnamic acid ester Enoate ester Fatty acid ester Fatty acyl Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Styrene logp 3.38 ALOGPS logs -3.44 ALOGPS solubility 6.88e-02 g/l ALOGPS logp 3.29 ChemAxon pka_strongest_basic -6.8 ChemAxon iupac propan-2-yl (2Z)-3-phenylprop-2-enoate ChemAxon average_mass 190.2384 ChemAxon mono_mass 190.099379692 ChemAxon smiles CC(C)OC(=O)\C=C/C1=CC=CC=C1 ChemAxon formula C12H14O2 ChemAxon inchi InChI=1S/C12H14O2/c1-10(2)14-12(13)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8- ChemAxon inchikey RGACABDFLVLVCT-HJWRWDBZSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 57 ChemAxon polarizability 21.16 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24677 Specdb::CMs 148558 Specdb::MsIr 7607 Specdb::MsIr 7608 Specdb::MsMs 320641 Specdb::MsMs 320642 Specdb::MsMs 320643 Specdb::MsMs 368062 Specdb::MsMs 368063 Specdb::MsMs 368064 Specdb::MsMs 2328210 Specdb::MsMs 2328211 Specdb::MsMs 2328212 Specdb::MsMs 2634907 Specdb::MsMs 2634908 Specdb::MsMs 2634909 HMDB37701 #<Reference:0x000055ce3170b818> balsam berry cinnamyl fruity peach strawberry tropical