1.0 2010-04-08 22:12:30 UTC 2015-07-20 23:30:54 UTC FDB016565 Ethyl methyl-p-tolylglycidate Flavouring ingredient Ethyl 2,3-epoxy-3-p-tolylbutyrate Ethyl 3-methyl-3-(4-methylphenyl)oxiranecarboxylate Ethyl 3-methyl-3-(p-tolyl)glycidate Ethyl methyl-p-methylphenylglycidate Ethyl methyl-p-tolylglycidate FEMA 3757 C13H16O3 220.2643 220.109944378 ethyl 3-methyl-3-(4-methylphenyl)oxirane-2-carboxylate ethyl 3-methyl-3-(4-methylphenyl)oxirane-2-carboxylate 74367-97-8 CCOC(=O)C1OC1(C)C1=CC=C(C)C=C1 InChI=1S/C13H16O3/c1-4-15-12(14)11-13(3,16-11)10-7-5-9(2)6-8-10/h5-8,11H,4H2,1-3H3 RJQNJKOCFCXTHZ-UHFFFAOYSA-N belongs to the class of organic compounds known as toluenes. Toluenes are compounds containing a benzene ring which bears a methane group. Toluenes Organic compounds Benzenoids Benzene and substituted derivatives Toluenes Aromatic heteromonocyclic compounds Carbonyl compounds Carboxylic acid esters Dialkyl ethers Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Oxirane carboxylic acids Aromatic heteromonocyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dialkyl ether Ether Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxirane Oxirane carboxylic acid Oxirane carboxylic acid or derivatives Toluene logp 2.66 ALOGPS logs -2.83 ALOGPS solubility 3.23e-01 g/l ALOGPS logp 2.72 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac ethyl 3-methyl-3-(4-methylphenyl)oxirane-2-carboxylate ChemAxon average_mass 220.2643 ChemAxon mono_mass 220.109944378 ChemAxon smiles CCOC(=O)C1OC1(C)C1=CC=C(C)C=C1 ChemAxon formula C13H16O3 ChemAxon inchi InChI=1S/C13H16O3/c1-4-15-12(14)11-13(3,16-11)10-7-5-9(2)6-8-10/h5-8,11H,4H2,1-3H3 ChemAxon inchikey RJQNJKOCFCXTHZ-UHFFFAOYSA-N ChemAxon polar_surface_area 38.83 ChemAxon refractivity 60.35 ChemAxon polarizability 24.28 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12303 Specdb::CMs 145912 Specdb::MsMs 85938 Specdb::MsMs 85939 Specdb::MsMs 85940 Specdb::MsMs 148128 Specdb::MsMs 148129 Specdb::MsMs 148130 Specdb::MsMs 2391499 Specdb::MsMs 2391500 Specdb::MsMs 2391501 Specdb::MsMs 2570702 Specdb::MsMs 2570703 Specdb::MsMs 2570704 HMDB37492 #<Reference:0x000055ce2e88e648> berry cherry floral fruity green powdery sweet