1.0 2010-04-08 22:15:46 UTC 2015-07-21 06:53:58 UTC FDB021553 p-Tolyl phenylacetate Flavouring ingredient 4-Methylphenyl benzeneacetate 4-Methylphenyl phenylacetate Acetic acid, phenyl-, p-tolyl ester Acetic acid, phenyl-, p-tolyl ester (6CI,7CI,8CI) Benzeneacetic acid, 4-methylphenyl ester Cresyl alpha-toluate, p- Cresyl phenylacetate, p- FEMA 3077 Methylphenyl alpha-toluate, p- Methylphenyl phenylacetate, p- P-cresyl &alpha;-toluate P-Cresyl alpha -toluate P-Cresyl alpha-toluate P-cresyl phenylacetate P-Methylphenyl alpha-toluate P-Methylphenyl phenylacetate P-tolyl &alpha;-toluate P-Tolyl alpha -toluate P-Tolyl alpha-toluate p-Tolyl phenylacetate Phenylacetic acid p-cresyl ester Phenylacetic acid, p-tolyl ester Tolyl alpha-toluate, p- C15H14O2 226.275 226.099379691 4-methylphenyl 2-phenylacetate 4-methylphenyl phenylacetate 101-94-0 CC1=CC=C(OC(=O)CC2=CC=CC=C2)C=C1 InChI=1S/C15H14O2/c1-12-7-9-14(10-8-12)17-15(16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 OJEQSSJFSNLMLB-UHFFFAOYSA-N belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group. Phenol esters Organic compounds Benzenoids Phenol esters Aromatic homomonocyclic compounds Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Phenoxy compounds Toluenes Aromatic homomonocyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol ester Phenoxy compound Toluene logp 3.87 ALOGPS logs -4.56 ALOGPS solubility 6.26e-03 g/l ALOGPS melting_point Mp 76° (EtOH) logp 3.93 ChemAxon pka_strongest_basic -7.2 ChemAxon iupac 4-methylphenyl 2-phenylacetate ChemAxon average_mass 226.275 ChemAxon mono_mass 226.099379691 ChemAxon smiles CC1=CC=C(OC(=O)CC2=CC=CC=C2)C=C1 ChemAxon formula C15H14O2 ChemAxon inchi InChI=1S/C15H14O2/c1-12-7-9-14(10-8-12)17-15(16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 ChemAxon inchikey OJEQSSJFSNLMLB-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 66.95 ChemAxon polarizability 25.27 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17220 Specdb::CMs 29153 Specdb::CMs 102213 Specdb::CMs 166247 Specdb::MsMs 69609 Specdb::MsMs 69610 Specdb::MsMs 69611 Specdb::MsMs 127929 Specdb::MsMs 127930 Specdb::MsMs 127931 Specdb::MsMs 2428978 Specdb::MsMs 2428979 Specdb::MsMs 2428980 Specdb::MsMs 2507299 Specdb::MsMs 2507300 Specdb::MsMs 2507301 HMDB41564 #<Reference:0x000055ce31960280> animal honey hyacinth lily narcissus rose