1.0 2010-04-08 22:11:51 UTC 2019-11-26 03:11:35 UTC FDB015447 1'-Acetoxyeugenol acetate Constituent of Alpinia galanga (greater galangal). 1'-Acetoxyeugenol acetate is found in herbs and spices. 1'-Acetoxyeugenol acetate C14H16O5 264.2738 264.099773622 1-[4-(acetyloxy)-3-methoxyphenyl]prop-2-en-1-yl acetate 1-[4-(acetyloxy)-3-methoxyphenyl]prop-2-en-1-yl acetate 52946-23-3 COC1=C(OC(C)=O)C=CC(=C1)C(OC(C)=O)C=C InChI=1S/C14H16O5/c1-5-12(18-9(2)15)11-6-7-13(19-10(3)16)14(8-11)17-4/h5-8,12H,1H2,2-4H3 NKRBAUXTIWONOV-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 Alkyl aryl ethers Anisoles Benzyloxycarbonyls Carbonyl compounds Carboxylic acid esters Dicarboxylic acids and derivatives Hydrocarbon derivatives Methoxybenzenes Organic oxides Phenoxy compounds Alkyl aryl ether Anisole Aromatic homomonocyclic compound Benzyloxycarbonyl Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dicarboxylic acid or derivatives Ether Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol ester Phenol ether Phenoxy compound logp 2.27 ALOGPS logs -3.52 ALOGPS solubility 8.05e-02 g/l ALOGPS logp 1.89 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac 1-[4-(acetyloxy)-3-methoxyphenyl]prop-2-en-1-yl acetate ChemAxon average_mass 264.2738 ChemAxon mono_mass 264.099773622 ChemAxon smiles COC1=C(OC(C)=O)C=CC(=C1)C(OC(C)=O)C=C ChemAxon formula C14H16O5 ChemAxon inchi InChI=1S/C14H16O5/c1-5-12(18-9(2)15)11-6-7-13(19-10(3)16)14(8-11)17-4/h5-8,12H,1H2,2-4H3 ChemAxon inchikey NKRBAUXTIWONOV-UHFFFAOYSA-N ChemAxon polar_surface_area 61.83 ChemAxon refractivity 68.45 ChemAxon polarizability 26.81 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18877 Specdb::CMs 156451 Specdb::MsMs 9371 Specdb::MsMs 9372 Specdb::MsMs 9373 Specdb::MsMs 16043 Specdb::MsMs 16044 Specdb::MsMs 16045 Specdb::MsMs 2755642 Specdb::MsMs 2755643 Specdb::MsMs 2755644 Specdb::MsMs 2952891 Specdb::MsMs 2952892 Specdb::MsMs 2952893 HMDB36544 #<Reference:0x000055ce320fd538> Herbs and Spices Unknown generic