1.0 2010-04-08 22:10:48 UTC 2015-07-20 23:00:38 UTC FDB013593 4-Methoxybenzyl propanoate Flavouring agent with a fruity taste 4-Methoxybenzenemethanol propanoate 4-Methoxybenzenemethyl propanoate 4-Methoxybenzyl propanoate 4-Methoxybenzyl propionate Anisyl propionate Benzenemethanol, 4-methoxy-, 1-propanoate Benzenemethanol, 4-methoxy-, propanoate Benzyl alcohol, p-methoxy-, propionate Benzyl alcohol, p-methoxy-, propionate (8CI) FEMA 2102 P-methoxybenzyl propionate Propionic acid, p-methoxybenzyl ester Propionic acid, p-methoxybenzyl ester (6CI) C11H14O3 194.2271 194.094294314 (4-methoxyphenyl)methyl propanoate (4-methoxyphenyl)methyl propanoate 7549-33-9 CCC(=O)OCC1=CC=C(OC)C=C1 InChI=1S/C11H14O3/c1-3-11(12)14-8-9-4-6-10(13-2)7-5-9/h4-7H,3,8H2,1-2H3 YWIJRJQYADFRTL-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 Alkyl aryl ethers Anisoles Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Methoxybenzenes Monocarboxylic acids and derivatives Organic oxides Phenoxy compounds Alkyl aryl ether Anisole Aromatic homomonocyclic compound Benzyloxycarbonyl Carbonyl group Carboxylic acid derivative Carboxylic acid ester Ether Hydrocarbon derivative Methoxybenzene Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Phenol ether Phenoxy compound logp 2.65 ALOGPS logs -3.08 ALOGPS solubility 1.63e-01 g/l ALOGPS logp 2.19 ChemAxon pka_strongest_basic -4.8 ChemAxon iupac (4-methoxyphenyl)methyl propanoate ChemAxon average_mass 194.2271 ChemAxon mono_mass 194.094294314 ChemAxon smiles CCC(=O)OCC1=CC=C(OC)C=C1 ChemAxon formula C11H14O3 ChemAxon inchi InChI=1S/C11H14O3/c1-3-11(12)14-8-9-4-6-10(13-2)7-5-9/h4-7H,3,8H2,1-2H3 ChemAxon inchikey YWIJRJQYADFRTL-UHFFFAOYSA-N ChemAxon polar_surface_area 35.53 ChemAxon refractivity 53.12 ChemAxon polarizability 21.23 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 9693 Specdb::CMs 162118 Specdb::MsIr 6762 Specdb::MsIr 6763 Specdb::MsMs 59640 Specdb::MsMs 59641 Specdb::MsMs 59642 Specdb::MsMs 115821 Specdb::MsMs 115822 Specdb::MsMs 115823 Specdb::MsMs 2386325 Specdb::MsMs 2386326 Specdb::MsMs 2386327 Specdb::MsMs 2578872 Specdb::MsMs 2578873 Specdb::MsMs 2578874 HMDB34990 #<Reference:0x000055ce3180a368> anisic cherry fruity herbal peach vanilla