1.0 2010-04-08 22:08:34 UTC 2018-05-28 23:23:29 UTC FDB009410 Ethyl trans-2-methyl-2-pentenoate It is used as a food additive . 2-Pentenoic acid, 2-methyl-, ethyl ester ethyl (2E)-2-methyl-2-pentenoate Ethyl (E)-2-methylpent-2-en-1-oate Ethyl 2-methylpent-2-en-1-oate C8H14O2 142.1956 142.099379692 ethyl (2E)-2-methylpent-2-enoate ethyl (2E)-2-methylpent-2-enoate 1617-40-9 CCOC(=O)C(\C)=C\CC InChI=1S/C8H14O2/c1-4-6-7(3)8(9)10-5-2/h6H,4-5H2,1-3H3/b7-6+ HYQYCHQAUPHFKX-VOTSOKGWSA-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 2.86 ALOGPS logs -1.69 ALOGPS solubility 2.92e+00 g/l ALOGPS logp 2.5 ChemAxon pka_strongest_basic -6.8 ChemAxon iupac ethyl (2E)-2-methylpent-2-enoate ChemAxon average_mass 142.1956 ChemAxon mono_mass 142.099379692 ChemAxon smiles CCOC(=O)C(\C)=C\CC ChemAxon formula C8H14O2 ChemAxon inchi InChI=1S/C8H14O2/c1-4-6-7(3)8(9)10-5-2/h6H,4-5H2,1-3H3/b7-6+ ChemAxon inchikey HYQYCHQAUPHFKX-VOTSOKGWSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 41.44 ChemAxon polarizability 16.73 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 5241 Specdb::MsIr 5242 Specdb::CMs 12310 Specdb::CMs 160655 Specdb::NmrOneD 112638 Specdb::NmrOneD 112639 Specdb::NmrOneD 112640 Specdb::NmrOneD 112641 Specdb::NmrOneD 112642 Specdb::NmrOneD 112643 Specdb::NmrOneD 112644 Specdb::NmrOneD 112645 Specdb::NmrOneD 112646 Specdb::NmrOneD 112647 Specdb::NmrOneD 112648 Specdb::NmrOneD 112649 Specdb::NmrOneD 112650 Specdb::NmrOneD 112651 Specdb::NmrOneD 112652 Specdb::NmrOneD 112653 Specdb::NmrOneD 112654 Specdb::NmrOneD 112655 Specdb::NmrOneD 112656 Specdb::NmrOneD 112657 Specdb::MsMs 104013 Specdb::MsMs 104014 Specdb::MsMs 104015 Specdb::MsMs 170190 Specdb::MsMs 170191 Specdb::MsMs 170192 Specdb::MsMs 2347127 Specdb::MsMs 2347128 Specdb::MsMs 2347129 Specdb::MsMs 2591932 Specdb::MsMs 2591933 Specdb::MsMs 2591934 HMDB32278 #<Reference:0x000055ce326aabc0> fruity