1.0 2010-04-08 22:09:33 UTC 2018-05-28 23:29:53 UTC FDB011272 Phenylmethyl benzeneacetate It is used in food flavouring. Acetic acid, phenyl-, benzyl ester Benzeneacetic acid, phenylmethyl ester Benzyl &alpha;-toluate Benzyl alpha-toluate Benzyl benzeneacetate Benzyl phenylacetate Benzylphenyl acetate Benzylphenylacetate FCC FEMA 2149 Phenylacetic acid, benzyl ester Phenylmethyl benzeneacetate, 9CI C15H14O2 226.2705 226.099379692 benzyl 2-phenylacetate benzyl 2-phenylacetate 102-16-9 O=C(CC1=CC=CC=C1)OCC1=CC=CC=C1 InChI=1S/C15H14O2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2 MIYFJEKZLFWKLZ-UHFFFAOYSA-N belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl group. Benzyloxycarbonyls Organic compounds Benzenoids Benzene and substituted derivatives Benzyloxycarbonyls Aromatic homomonocyclic compounds Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aromatic homomonocyclic compound Benzyloxycarbonyl Carbonyl group Carboxylic acid derivative Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound logp 3.72 ALOGPS logs -4.35 ALOGPS solubility 1.00e-02 g/l ALOGPS logp 3.48 ChemAxon pka_strongest_basic -7.1 ChemAxon iupac benzyl 2-phenylacetate ChemAxon average_mass 226.2705 ChemAxon mono_mass 226.099379692 ChemAxon smiles O=C(CC1=CC=CC=C1)OCC1=CC=CC=C1 ChemAxon formula C15H14O2 ChemAxon inchi InChI=1S/C15H14O2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2 ChemAxon inchikey MIYFJEKZLFWKLZ-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 66.75 ChemAxon polarizability 24.79 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23507 Specdb::CMs 28203 Specdb::CMs 28845 Specdb::CMs 29139 Specdb::CMs 101323 Specdb::CMs 101324 Specdb::CMs 101325 Specdb::CMs 148887 Specdb::MsMs 82854 Specdb::MsMs 82855 Specdb::MsMs 82856 Specdb::MsMs 144336 Specdb::MsMs 144337 Specdb::MsMs 144338 Specdb::MsMs 2816266 Specdb::MsMs 2816267 Specdb::MsMs 2816268 Specdb::MsMs 2892506 Specdb::MsMs 2892507 Specdb::MsMs 2892508 HMDB33251 #<Reference:0x000055ce2efd39a8> cocoa floral honey jasmin sweet