1.0 2010-04-08 22:12:37 UTC 2015-07-20 23:32:07 UTC FDB016738 Isopropyl tiglate Flavouring ingredient (E)-1-Methylethyl 2-methyl-2-butenoate 1-Methylethyl 2-methyl-2-butenoate, (E)- 2-Butenoic acid, 2-methyl-, 1-isopropyl ester, (E)- 2-Butenoic acid, 2-methyl-, 1-methylethyl ester, (2E)- 2-Butenoic acid, 2-methyl-, 1-methylethyl ester, (E)- 2-Butenoic acid, 2-methyl-, 1-methylethyl ester, (E)- (9CI) 2-Butenoic acid, 2-methyl, 1-isopropyl ester (E)- 2-Butenoicacid, 2-methyl-, propyl ester, (E)- 2-Methyl-1-isopropyl ester(e)-2-butenoic acid 2-Methyl-1-methylethyl ester(2e)-2-butenoic acid 2-Methyl-1-methylethyl ester(e)-2-butenoic acid 2-Methyl-propyl ester(e)-2-butenoicacid 2-Methyl1-isopropyl ester (e)-2-butenoic acid 3-Methyl-2-butenoic acid, isopropyl ester 3-Methyl,2-butenoic acid,isopropyl ester FEMA 3229 Isopropyl (2E)-2-methyl-2-butenoate Isopropyl &alpha;-methyl crotonate Isopropyl 2-methyl-2-butenoate Isopropyl 2-methylcrotonate Isopropyl 3-methyl-2-butenoate Isopropyl alpha -methyl crotonate Isopropyl alpha-methyl crotonate Isopropyl alpha-methylcrotonate Isopropyl tiglate Isopropyltiglate Tiglic acid isopropyl ester C8H14O2 142.1956 142.099379692 propan-2-yl (2Z)-2-methylbut-2-enoate isopropyl (2Z)-2-methylbut-2-enoate 1733-25-1 C\C=C(\C)C(=O)OC(C)C InChI=1S/C8H14O2/c1-5-7(4)8(9)10-6(2)3/h5-6H,1-4H3/b7-5- VUPBIVVRPJDWNW-ALCCZGGFSA-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 2.64 ALOGPS logs -1.66 ALOGPS solubility 3.11e+00 g/l ALOGPS logp 2.47 ChemAxon pka_strongest_basic -6.8 ChemAxon iupac propan-2-yl (2Z)-2-methylbut-2-enoate ChemAxon average_mass 142.1956 ChemAxon mono_mass 142.099379692 ChemAxon smiles C\C=C(\C)C(=O)OC(C)C ChemAxon formula C8H14O2 ChemAxon inchi InChI=1S/C8H14O2/c1-5-7(4)8(9)10-6(2)3/h5-6H,1-4H3/b7-5- ChemAxon inchikey VUPBIVVRPJDWNW-ALCCZGGFSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 41.26 ChemAxon polarizability 16.3 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15739 Specdb::CMs 150524 Specdb::MsIr 7565 Specdb::MsIr 7566 Specdb::MsMs 300904 Specdb::MsMs 300905 Specdb::MsMs 300906 Specdb::MsMs 343291 Specdb::MsMs 343292 Specdb::MsMs 343293 Specdb::MsMs 2819709 Specdb::MsMs 2819710 Specdb::MsMs 2819711 Specdb::MsMs 2889250 Specdb::MsMs 2889251 Specdb::MsMs 2889252 Specdb::NmrOneD 22442 Specdb::NmrOneD 22443 Specdb::NmrOneD 22444 Specdb::NmrOneD 22445 Specdb::NmrOneD 22446 Specdb::NmrOneD 22447 Specdb::NmrOneD 22448 Specdb::NmrOneD 22449 Specdb::NmrOneD 22450 Specdb::NmrOneD 22451 Specdb::NmrOneD 22452 Specdb::NmrOneD 22453 Specdb::NmrOneD 22454 Specdb::NmrOneD 22455 Specdb::NmrOneD 22456 Specdb::NmrOneD 22457 Specdb::NmrOneD 22458 Specdb::NmrOneD 22459 Specdb::NmrOneD 22460 Specdb::NmrOneD 22461 HMDB37624 #<Reference:0x000055ce32571e70> green mint spice sweet vegetable