1.0 2010-04-08 22:04:43 UTC 2015-07-20 21:34:42 UTC FDB000810 3-(4-Methylphenyl)-2-propenal Flavouring ingredient (2E)-3-(4-methylphenyl)-2-propenal 2-Propenal, 3-(4-methylphenyl)- 3-(P-Methylphenyl)propenal 3-p-Tolylacrolein 3-p-tolylacrylaldehyde 3-p-Tolylprop-2-enal 3-P-Tolylpropenal 4-Methylcinnamaldehyde Cinnamaldehyde, p-methyl- FEMA 3640 Methylcinnamaldehyde, p- P-Methyl-cinnamaldehyde P-methylcinnamaldehyde p-Methylcinnamaldehyde, 8CI C10H10O 146.1858 146.073164942 (2E)-3-(4-methylphenyl)prop-2-enal (2E)-3-(4-methylphenyl)prop-2-enal 1504-75-2 CC1=CC=C(\C=C\C=O)C=C1 InChI=1S/C10H10O/c1-9-4-6-10(7-5-9)3-2-8-11/h2-8H,1H3/b3-2+ DKOUYOVAEBQFHU-NSCUHMNNSA-N belongs to the class of organic compounds known as cinnamaldehydes. These are organic aromatic compounds containing a cinnamlaldehyde moiety, consisting of a benzene and an aldehyde group to form 3-phenylprop-2-enal. Cinnamaldehydes Organic compounds Phenylpropanoids and polyketides Cinnamaldehydes Aromatic homomonocyclic compounds Aldehydes Enals Hydrocarbon derivatives Organic oxides Styrenes Toluenes Aldehyde Alpha,beta-unsaturated aldehyde Aromatic homomonocyclic compound Benzenoid Carbonyl group Cinnamaldehyde Enal Hydrocarbon derivative Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Styrene Toluene Solid logp 2.34 ALOGPS logs -2.85 ALOGPS solubility 2.09e-01 g/l ALOGPS melting_point Mp 41.5° logp 2.49 ChemAxon pka_strongest_basic -4.4 ChemAxon iupac (2E)-3-(4-methylphenyl)prop-2-enal ChemAxon average_mass 146.1858 ChemAxon mono_mass 146.073164942 ChemAxon smiles CC1=CC=C(\C=C\C=O)C=C1 ChemAxon formula C10H10O ChemAxon inchi InChI=1S/C10H10O/c1-9-4-6-10(7-5-9)3-2-8-11/h2-8H,1H3/b3-2+ ChemAxon inchikey DKOUYOVAEBQFHU-NSCUHMNNSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 47.18 ChemAxon polarizability 16.7 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23513 Specdb::CMs 137733 Specdb::CMs 145467 Specdb::MsMs 60822 Specdb::MsMs 60823 Specdb::MsMs 60824 Specdb::MsMs 117240 Specdb::MsMs 117241 Specdb::MsMs 117242 Specdb::MsMs 2392612 Specdb::MsMs 2392613 Specdb::MsMs 2392614 Specdb::MsMs 2569994 Specdb::MsMs 2569995 Specdb::MsMs 2569996 Specdb::MsIr 3523 Specdb::MsIr 3524 HMDB29640 #<Reference:0x000055ce320581c8> cinnamon spicy