1.0 2010-04-08 22:09:10 UTC 2015-07-20 22:33:12 UTC FDB010528 Dehydrozingerone Flavouring ingredient [0]-Dehydroparadol [0]-Paradol, dehydro- 3-Buten-2-one, 4-(4-hydroxy-3-methoxyphenyl)- 3-Methoxy-4-hydroxybenzalacetone 4-(4-Hydroxy-3-methoxyphenyl)-3-buten-2-one 4-hydroxy-3-methoxybenzalacetone 4-Hydroxy-3-methoxybenzylideneacetone 4-Hydroxy-3-methoxystyryl methyl ketone dehydro-[0]-Paradol Dehydrozingerol Dehydrozingerone FEMA 3738 Feruloylmethane Methyl-3-methoxy-4-hydroxy styryl ketone MHSK Vanillalacetone Vanillidene acetone Vanillylidenacetone Vanillylidene acetone Vanylidenacetone C11H12O3 192.2112 192.07864425 (3Z)-4-(4-hydroxy-3-methoxyphenyl)but-3-en-2-one (3Z)-4-(4-hydroxy-3-methoxyphenyl)but-3-en-2-one 1080-12-2 COC1=C(O)C=CC(\C=C/C(C)=O)=C1 InChI=1S/C11H12O3/c1-8(12)3-4-9-5-6-10(13)11(7-9)14-2/h3-7,13H,1-2H3/b4-3- AFWKBSMFXWNGRE-ARJAWSKDSA-N belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. Hydroxycinnamic acids and derivatives are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated. Hydroxycinnamic acids and derivatives Organic compounds Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Acryloyl compounds Alkyl aryl ethers Anisoles Enones Hydrocarbon derivatives Ketones Methoxybenzenes Methoxyphenols Organic oxides Phenoxy compounds Styrenes 1-hydroxy-2-unsubstituted benzenoid Acryloyl-group Alkyl aryl ether Alpha,beta-unsaturated ketone Anisole Aromatic homomonocyclic compound Benzenoid Carbonyl group Enone Ether Hydrocarbon derivative Hydroxycinnamic acid or derivatives Ketone Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol Phenol ether Phenoxy compound Styrene logp 2.17 ALOGPS logs -2.54 ALOGPS solubility 5.50e-01 g/l ALOGPS melting_point Mp 129-130° logp 2 ChemAxon pka_strongest_acidic 9.51 ChemAxon pka_strongest_basic -4.5 ChemAxon iupac (3Z)-4-(4-hydroxy-3-methoxyphenyl)but-3-en-2-one ChemAxon average_mass 192.2112 ChemAxon mono_mass 192.07864425 ChemAxon smiles COC1=C(O)C=CC(\C=C/C(C)=O)=C1 ChemAxon formula C11H12O3 ChemAxon inchi InChI=1S/C11H12O3/c1-8(12)3-4-9-5-6-10(13)11(7-9)14-2/h3-7,13H,1-2H3/b4-3- ChemAxon inchikey AFWKBSMFXWNGRE-ARJAWSKDSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 55.06 ChemAxon polarizability 19.94 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25998 Specdb::CMs 42866 Specdb::CMs 146456 Specdb::MsIr 5585 Specdb::MsIr 5586 Specdb::MsIr 5587 Specdb::MsMs 323599 Specdb::MsMs 323600 Specdb::MsMs 323601 Specdb::MsMs 371797 Specdb::MsMs 371798 Specdb::MsMs 371799 Specdb::MsMs 2280202 Specdb::MsMs 2280203 Specdb::MsMs 2280204 Specdb::MsMs 3089482 Specdb::MsMs 3089483 Specdb::MsMs 3089484 HMDB32591 #<Reference:0x000055ce32cf6420> #<Reference:0x000055ce32cf6268> balsam creamy powdery sweet vanilla