1.0 2010-04-08 22:09:11 UTC 2019-11-26 03:03:49 UTC FDB010567 1-Phenyl-1-propanone Present in Camembert cheese, coffee, tea and roasted nuts. Flavouring ingredient. 1-Phenyl-1-propanone is found in many foods, some of which are tea, coffee and coffee products, nuts, and milk and milk products. 1-Phenyl-propan-1-one 1-phenylpropanone 1-Propanone, 1-phenyl- 1-PROPANONE,1-PHENYL PROPIOPHENONE Benzoylethane Ethyl phenyl ketone FEMA 3469 Ketone, ethyl phenyl Phenetol Phenyl ethyl ketone Propionphenone Propionylbenzene Propiophenone C9H10O 134.1751 134.073164942 1-phenylpropan-1-one propiophenone 93-55-0 CCC(=O)C1=CC=CC=C1 InChI=1S/C9H10O/c1-2-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3 KRIOVPPHQSLHCZ-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 Aryl alkyl ketones Benzoyl derivatives Hydrocarbon derivatives Organic oxides Phenylpropanes Alkyl-phenylketone Aromatic homomonocyclic compound Aryl alkyl ketone Benzenoid Benzoyl Hydrocarbon derivative Monocyclic benzene moiety Organic oxide Phenylpropane aromatic ketone propanone Liquid logp 2.15 ALOGPS logs -2.12 ALOGPS solubility 1.01e+00 g/l ALOGPS melting_point Mp 19-20° logp 2.23 ChemAxon pka_strongest_acidic 16.69 ChemAxon pka_strongest_basic -7.4 ChemAxon iupac 1-phenylpropan-1-one ChemAxon average_mass 134.1751 ChemAxon mono_mass 134.073164942 ChemAxon smiles CCC(=O)C1=CC=CC=C1 ChemAxon formula C9H10O ChemAxon inchi InChI=1S/C9H10O/c1-2-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3 ChemAxon inchikey KRIOVPPHQSLHCZ-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 41.09 ChemAxon polarizability 15.16 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10768 Specdb::CMs 27108 Specdb::CMs 27283 Specdb::CMs 27724 Specdb::CMs 27780 Specdb::CMs 28667 Specdb::CMs 101234 Specdb::CMs 101235 Specdb::CMs 101236 Specdb::CMs 101237 Specdb::CMs 101238 Specdb::CMs 157063 Specdb::MsMs 83190 Specdb::MsMs 83191 Specdb::MsMs 83192 Specdb::MsMs 144735 Specdb::MsMs 144736 Specdb::MsMs 144737 Specdb::MsMs 2420307 Specdb::MsMs 2420308 Specdb::MsMs 2420309 Specdb::MsMs 2545357 Specdb::MsMs 2545358 Specdb::MsMs 2545359 Specdb::MsIr 5645 Specdb::MsIr 5646 HMDB32623 I1E #<Reference:0x000055ce302a5b80> Arabica coffee Type 1 specific Coffea arabica 13443 Black tea Type 1 Coffee and coffee products Unknown generic Green tea Type 1 Herbal tea Type 1 Milk and milk products Unknown generic Nuts Unknown generic Red tea Type 1 Robusta coffee Type 1 specific Coffea canephora 49390 Tea Type 1 specific Camellia sinensis 4442 hawthorn lilac