1.0 2010-04-08 22:12:15 UTC 2015-07-20 23:25:58 UTC FDB016140 3-(4-Methoxyphenyl)-2-methyl-2-propenal Flavouring ingredient α-methyl p-methoxy cinnamic aldehyde 2-Methyl-3-(4-methoxyphenyl)-2-propenal 2-Propenal, 3-(4-methoxyphenyl)-2-methyl- 3-(4-Methoxyphenyl)-2-methylacrylaldehyde alpha -Methyl P-methoxy cinnamic aldehyde FEMA 3182 P-methoxy-α-methylcinnamaldehyde p-Methoxy-a-methylcinnamaldehyde P-Methoxy-alpha -methylcinnamaldehyde C11H12O2 176.2118 176.083729628 (2E)-3-(4-methoxyphenyl)-2-methylprop-2-enal (2E)-3-(4-methoxyphenyl)-2-methylprop-2-enal 65405-67-6 COC1=CC=C(\C=C(/C)C=O)C=C1 InChI=1S/C11H12O2/c1-9(8-12)7-10-3-5-11(13-2)6-4-10/h3-8H,1-2H3/b9-7+ BNBBFUJNMYQYLA-VQHVLOKHSA-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 Alkyl aryl ethers Anisoles Enals Hydrocarbon derivatives Methoxybenzenes Organic oxides Phenoxy compounds Aldehyde Alkyl aryl ether Alpha,beta-unsaturated aldehyde Anisole Aromatic homomonocyclic compound Benzenoid Carbonyl group Cinnamaldehyde Enal Ether Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol ether Phenoxy compound logp 2.37 ALOGPS logs -2.98 ALOGPS solubility 1.84e-01 g/l ALOGPS logp 2.22 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac (2E)-3-(4-methoxyphenyl)-2-methylprop-2-enal ChemAxon average_mass 176.2118 ChemAxon mono_mass 176.083729628 ChemAxon smiles COC1=CC=C(\C=C(/C)C=O)C=C1 ChemAxon formula C11H12O2 ChemAxon inchi InChI=1S/C11H12O2/c1-9(8-12)7-10-3-5-11(13-2)6-4-10/h3-8H,1-2H3/b9-7+ ChemAxon inchikey BNBBFUJNMYQYLA-VQHVLOKHSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 52.95 ChemAxon polarizability 19.36 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25551 Specdb::CMs 131471 Specdb::CMs 139205 Specdb::MsIr 7407 Specdb::MsIr 7408 Specdb::MsMs 322624 Specdb::MsMs 322625 Specdb::MsMs 322626 Specdb::MsMs 370579 Specdb::MsMs 370580 Specdb::MsMs 370581 Specdb::MsMs 2368665 Specdb::MsMs 2368666 Specdb::MsMs 2368667 Specdb::MsMs 2566313 Specdb::MsMs 2566314 Specdb::MsMs 2566315 HMDB37145 #<Reference:0x000055ce31ce9fc8> cinnamon floral spicy