1.0 2010-04-08 22:15:19 UTC 2025-11-19 02:34:11 UTC FDB020865 1'S-Acetoxychavicol acetate Constituent of Alpinia galanga (greater galangal). 1'S-Acetoxychavicol acetate is found in herbs and spices. (1S)-1-[4-(acetyloxy)phenyl]prop-2-en-1-yl acetate (alphaS)-4-(Acetyloxy)-alpha-ethenylbenzenemethanol 1'-Acetoxychavicol acetate 1'S-1'-Acetoxychavicol acetate Galangal acetate C13H14O4 234.2479 234.089208936 1-[4-(acetyloxy)phenyl]prop-2-en-1-yl acetate 1-[4-(acetyloxy)phenyl]prop-2-en-1-yl acetate 52946-22-2 CC(=O)OC(C=C)C1=CC=C(OC(C)=O)C=C1 InChI=1S/C13H14O4/c1-4-13(17-10(3)15)11-5-7-12(8-6-11)16-9(2)14/h4-8,13H,1H2,2-3H3 JAMQIUWGGBSIKZ-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 Benzyloxycarbonyls Carbonyl compounds Carboxylic acid esters Dicarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Phenoxy compounds Aromatic homomonocyclic compound Benzyloxycarbonyl Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dicarboxylic acid or derivatives Hydrocarbon derivative Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol ester Phenoxy compound logp 2.58 ALOGPS logs -3.31 ALOGPS solubility 1.15e-01 g/l ALOGPS logp 2.05 ChemAxon pka_strongest_basic -6.8 ChemAxon iupac 1-[4-(acetyloxy)phenyl]prop-2-en-1-yl acetate ChemAxon average_mass 234.2479 ChemAxon mono_mass 234.089208936 ChemAxon smiles CC(=O)OC(C=C)C1=CC=C(OC(C)=O)C=C1 ChemAxon formula C13H14O4 ChemAxon inchi InChI=1S/C13H14O4/c1-4-13(17-10(3)15)11-5-7-12(8-6-11)16-9(2)14/h4-8,13H,1H2,2-3H3 ChemAxon inchikey JAMQIUWGGBSIKZ-UHFFFAOYSA-N ChemAxon polar_surface_area 52.6 ChemAxon refractivity 61.99 ChemAxon polarizability 24.28 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22932 Specdb::CMs 163599 Specdb::MsMs 316924 Specdb::MsMs 316925 Specdb::MsMs 316926 Specdb::MsMs 363295 Specdb::MsMs 363296 Specdb::MsMs 363297 Specdb::MsMs 2454529 Specdb::MsMs 2454530 Specdb::MsMs 2454531 Specdb::MsMs 2484057 Specdb::MsMs 2484058 Specdb::MsMs 2484059 HMDB0041005 Herbs and Spices Unknown generic