1.0 2010-04-08 22:09:29 UTC 2015-07-20 22:38:17 UTC FDB011132 3-Acetylpyridine Organoleptic, flavouring ingredient &beta;-acetylpyridine 1-(3-Pyridenyl)ethanone 1-(3-Pyridinyl)-ethanone 1-(3-Pyridinyl)ethanone 1-(3-Pyridinyl)ethanone, 9CI 1-pyridin-3-ylethanone 3-Acetopyridine 3-Acetyl-pyridine 3-Pyridyl methyl ketone beta -Acetylpyridine Beta-acetylpyridine C7H7NO Ethanone, 1-(3-pyridinyl)- FEMA 3424 Ketone, methyl 3-pyridyl Methyl &beta;-pyridyl ketone Methyl 3-pyridyl ketone Methyl beta -pyridyl ketone Methyl pyridyl ketone MP silica TLC Pyridine, 3-acetyl- PYRIDINE,3-ACETYL C7H7NO 121.1366 121.052763851 1-(pyridin-3-yl)ethan-1-one 3-acetylpyridine 350-03-8 CC(=O)C1=CN=CC=C1 InChI=1S/C7H7NO/c1-6(9)7-3-2-4-8-5-7/h2-5H,1H3 WEGYGNROSJDEIW-UHFFFAOYSA-N belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group. Aryl alkyl ketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aromatic heteromonocyclic compounds Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Pyridines and derivatives Aromatic heteromonocyclic compound Aryl alkyl ketone Azacycle Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxide Organoheterocyclic compound Organonitrogen compound Organopnictogen compound Pyridine Liquid logp 0.45 ALOGPS logs 0.08 ALOGPS solubility 1.47e+02 g/l ALOGPS melting_point 13.5 oC logp 0.31 ChemAxon pka_strongest_acidic 15.55 ChemAxon pka_strongest_basic 3.82 ChemAxon iupac 1-(pyridin-3-yl)ethan-1-one ChemAxon average_mass 121.1366 ChemAxon mono_mass 121.052763851 ChemAxon smiles CC(=O)C1=CN=CC=C1 ChemAxon formula C7H7NO ChemAxon inchi InChI=1S/C7H7NO/c1-6(9)7-3-2-4-8-5-7/h2-5H,1H3 ChemAxon inchikey WEGYGNROSJDEIW-UHFFFAOYSA-N ChemAxon polar_surface_area 29.96 ChemAxon refractivity 34.3 ChemAxon polarizability 12.39 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12128 Specdb::CMs 159250 Specdb::MsMs 87651 Specdb::MsMs 87652 Specdb::MsMs 87653 Specdb::MsMs 150189 Specdb::MsMs 150190 Specdb::MsMs 150191 Specdb::MsMs 2421927 Specdb::MsMs 2421928 Specdb::MsMs 2421929 Specdb::MsMs 2513588 Specdb::MsMs 2513589 Specdb::MsMs 2513590 Specdb::MsIr 5979 Specdb::MsIr 5980 HMDB33131 #<Reference:0x000055ce33271c60> dry hawthorn nutty phenolic popcorn sweet woody