1.0 2010-04-08 22:10:05 UTC 2019-11-26 03:06:32 UTC FDB012289 Methylxanthoxylin Isolated from Java plum blossom (Eugenia jambolana). Methylxanthoxylin is found in fruits. 2'-Hydroxy-4',6'-dimethoxy-3'-methylacetophenone Methylxanthoxylin C11H14O4 210.2265 210.089208936 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)ethan-1-one 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)ethanone 23121-32-6 COC1=CC(OC)=C(C(C)=O)C(O)=C1C InChI=1S/C11H14O4/c1-6-8(14-3)5-9(15-4)10(7(2)12)11(6)13/h5,13H,1-4H3 AAOFJKLTRKOQTQ-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-4-unsubstituted benzenoids Acetophenones Alkyl aryl ethers Anisoles Aryl alkyl ketones Benzoyl derivatives Dimethoxybenzenes Hydrocarbon derivatives Methoxyphenols Organic oxides Ortho cresols Phenoxy compounds Toluenes Vinylogous acids 1-hydroxy-4-unsubstituted benzenoid Acetophenone Alkyl aryl ether Alkyl-phenylketone Anisole Aromatic homomonocyclic compound Aryl alkyl ketone Benzenoid Benzoyl Dimethoxybenzene Ether Hydrocarbon derivative M-dimethoxybenzene Methoxybenzene Methoxyphenol Monocyclic benzene moiety O-cresol Organic oxide Phenol Phenol ether Phenoxy compound Toluene Vinylogous acid logp 1.99 ALOGPS logs -2.25 ALOGPS solubility 1.19e+00 g/l ALOGPS melting_point Mp 143° logp 2.08 ChemAxon pka_strongest_acidic 10.51 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)ethan-1-one ChemAxon average_mass 210.2265 ChemAxon mono_mass 210.089208936 ChemAxon smiles COC1=CC(OC)=C(C(C)=O)C(O)=C1C ChemAxon formula C11H14O4 ChemAxon inchi InChI=1S/C11H14O4/c1-6-8(14-3)5-9(15-4)10(7(2)12)11(6)13/h5,13H,1-4H3 ChemAxon inchikey AAOFJKLTRKOQTQ-UHFFFAOYSA-N ChemAxon polar_surface_area 55.76 ChemAxon refractivity 56.41 ChemAxon polarizability 21.77 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 6398 Specdb::MsIr 6399 Specdb::MsIr 6400 Specdb::CMs 26237 Specdb::CMs 43675 Specdb::CMs 130466 Specdb::CMs 138200 Specdb::MsMs 89475 Specdb::MsMs 89476 Specdb::MsMs 89477 Specdb::MsMs 152421 Specdb::MsMs 152422 Specdb::MsMs 152423 Specdb::MsMs 2232773 Specdb::MsMs 2233773 Specdb::MsMs 2235199 Specdb::MsMs 2297725 Specdb::MsMs 2297726 Specdb::MsMs 2297727 Specdb::MsMs 2638087 Specdb::MsMs 2638088 Specdb::MsMs 2638089 HMDB34047 #<Reference:0x00007f093c099bf0> Fruits Unknown generic