1.0 2010-04-08 22:04:32 UTC 2025-11-18 22:17:12 UTC FDB000359 3'-Methoxyacetophenone 3'-methoxyacetophenone 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. 3'-methoxyacetophenone is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). 3'-methoxyacetophenone can be found in sesame, which makes 3'-methoxyacetophenone a potential biomarker for the consumption of this food product. 1-(3-Methoxyphenyl)-ethanone 1-(3-Methoxyphenyl)ethanone 1-Acetyl-3-methoxybenzene 3-Acetylanisole 3-Methoxyacetophenone m-Acetanisole m-Methoxyacetophenone m-Metoxyacetophenone Methyl 3-methoxyphenyl ketone C9H10O2 150.1745 150.068079564 1-(3-methoxyphenyl)ethan-1-one M-methoxyacetophenone 586-37-8 COC1=CC(=CC=C1)C(C)=O InChI=1S/C9H10O2/c1-7(10)8-4-3-5-9(6-8)11-2/h3-6H,1-2H3 BAYUSCHCCGXLAY-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 Acetophenones Alkyl aryl ethers Anisoles Aryl alkyl ketones Benzoyl derivatives Hydrocarbon derivatives Methoxybenzenes Organic oxides Phenoxy compounds Acetophenone Alkyl aryl ether Alkyl-phenylketone Anisole Aromatic homomonocyclic compound Aryl alkyl ketone Benzenoid Benzoyl Ether Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Organic oxide Phenol ether Phenoxy compound liquid logp 1.77 ALOGPS logs -2.15 ALOGPS solubility 1.05e+00 g/l ALOGPS melting_point 95.5 oC logp 1.37 ChemAxon pka_strongest_acidic 15.95 ChemAxon pka_strongest_basic -4.8 ChemAxon iupac 1-(3-methoxyphenyl)ethan-1-one ChemAxon average_mass 150.1745 ChemAxon mono_mass 150.068079564 ChemAxon smiles COC1=CC(=CC=C1)C(C)=O ChemAxon formula C9H10O2 ChemAxon inchi InChI=1S/C9H10O2/c1-7(10)8-4-3-5-9(6-8)11-2/h3-6H,1-2H3 ChemAxon inchikey BAYUSCHCCGXLAY-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 42.92 ChemAxon polarizability 15.99 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 5932 Specdb::MsMs 61614 Specdb::MsMs 61615 Specdb::MsMs 61616 Specdb::MsMs 118179 Specdb::MsMs 118180 Specdb::MsMs 118181 Specdb::MsMs 3597124 Specdb::MsMs 3597125 Specdb::MsMs 3597126 Specdb::MsMs 3597127 Specdb::MsMs 3597128 Specdb::MsMs 3597129 Sesame Type 1 specific Sesamum orientale 4182 1.85885 1.858850024 1.858850024 mg/100 g