1.0 2010-04-08 22:09:58 UTC 2025-11-18 23:33:27 UTC FDB012055 Acetovanillone Acetovanillone, also known as 4'-hydroxy-3'-methoxyacetophenone or acetoguaiacon, is a member of the class of compounds known as alkyl-phenylketones. Alkyl-phenylketones are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. Acetovanillone is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Acetovanillone is a faint, sweet, and vanillin tasting compound found in corn and garden onion, which makes acetovanillone a potential biomarker for the consumption of these food products. Acetovanillone may be a unique S.cerevisiae (yeast) metabolite. -acetylguaiacol -Hydroxy-3-methoxyphenyl methyl keton -Methoxy-4-acetylphenol '-Methoxy-4'-hydroxyacetophenone 1-(4-hydroxy-3-methoxyphenyl)-ethanone 1-(4-Hydroxy-3-methoxyphenyl)-ethanone (acetovanillone) 1-(4-hydroxy-3-methoxyphenyl)ethan-1-one 1-(4-Hydroxy-3-methoxyphenyl)ethanone 2-Methoxy-4-acetylphenol 3-Methoxy-4-hydroxyacetophenone 3-Metoksy-4-hydroksyacetofenon 3'-Methoxy-4'-hydroxyacetophenone 4-Acetyl-2-methoxyphenol 4-Acetylguaiacol 4-Hydroxy-3-methoxyacetophenone 4-Hydroxy-3-methoxyphenyl methyl keton 4-Hydroxy-3-methoxyphenyl methyl ketone 4'-H-3'-MAP 4'-Hydroxy-3'-methoxyacetophenone, 8CI Acetoguaiacon Acetoguaiacone Acetophenone, 4'-hydroxy-3'-methoxy- ACETOPHENONE,4-HYDROXY,3-METHOXY ACETOVANILLON Acetovanillon Acetovanillone Acetovanilone Acetovanyllon Apocynin Apocynine Ethanone, 1-(4-hydroxy-3-methoxyphenyl)- Phenol, 4-acetyl-2-methoxy Vanilloyl methyl ketone C9H10O3 166.1739 166.062994186 1-(4-hydroxy-3-methoxyphenyl)ethan-1-one apocynin 498-02-2 COC1=C(O)C=CC(=C1)C(C)=O InChI=1S/C9H10O3/c1-6(10)7-3-4-8(11)9(5-7)12-2/h3-5,11H,1-2H3 DFYRUELUNQRZTB-UHFFFAOYSA-N belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. Alkyl-phenylketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Acetophenones Alkyl aryl ethers Anisoles Aryl alkyl ketones Benzoyl derivatives Hydrocarbon derivatives Methoxybenzenes Methoxyphenols Organic oxides Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoid Acetophenone Alkyl aryl ether Alkyl-phenylketone Anisole Aromatic homomonocyclic compound Aryl alkyl ketone Benzenoid Benzoyl Ether Hydrocarbon derivative Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic oxide Phenol Phenol ether Phenoxy compound Flavans, Flavanols and Leucoanthocyanidins acetophenones aromatic ketone methyl ketone logp 1.62 ALOGPS logs -1.74 ALOGPS solubility 3.04e+00 g/l ALOGPS melting_point Mp 115° logp 1.07 ChemAxon pka_strongest_acidic 8.27 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac 1-(4-hydroxy-3-methoxyphenyl)ethan-1-one ChemAxon average_mass 166.1739 ChemAxon mono_mass 166.062994186 ChemAxon smiles COC1=C(O)C=CC(=C1)C(C)=O ChemAxon formula C9H10O3 ChemAxon inchi InChI=1S/C9H10O3/c1-6(10)7-3-4-8(11)9(5-7)12-2/h3-5,11H,1-2H3 ChemAxon inchikey DFYRUELUNQRZTB-UHFFFAOYSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 44.9 ChemAxon polarizability 16.94 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1858 Specdb::CMs 2873 Specdb::CMs 127424 Specdb::CMs 837622 Specdb::CMs 837623 Specdb::MsMs 55461 Specdb::MsMs 55462 Specdb::MsMs 55463 Specdb::MsMs 110613 Specdb::MsMs 110614 Specdb::MsMs 110615 Specdb::MsMs 3413288 Specdb::MsMs 3413289 Specdb::MsMs 3413290 Specdb::MsMs 3414266 Specdb::MsMs 3414267 Specdb::MsMs 3414268 Specdb::NmrOneD 3880 Specdb::NmrOneD 4150 Specdb::NmrOneD 206307 Specdb::NmrOneD 206308 Specdb::NmrOneD 206309 Specdb::NmrOneD 206310 Specdb::NmrOneD 206311 Specdb::NmrOneD 206312 Specdb::NmrOneD 206313 Specdb::NmrOneD 206314 Specdb::NmrOneD 206315 Specdb::NmrOneD 206316 Specdb::NmrOneD 206317 Specdb::NmrOneD 206318 Specdb::NmrOneD 206319 Specdb::NmrOneD 206320 Specdb::NmrOneD 206321 Specdb::NmrOneD 206322 Specdb::NmrOneD 206323 Specdb::NmrOneD 206324 Specdb::NmrOneD 206325 Specdb::NmrOneD 206326 2781 Asparagus Type 1 specific Asparagus officinalis 4686 Corn Type 1 specific Zea mays 4577 Garden onion Type 1 specific Allium cepa 4679 White wine Type 2 0.229 0.229 0.229 mg/100 g faint sweet vanilla vanillin NADPH-oxidase inhibitor 1137 An EC 1.6.3.* (oxidoreductase acting on NADH or NADPH with oxygen as acceptor) inhibitor that interferes with the action of NAD(P)H oxidase (H2O2-forming), EC 1.6.3.1.