1.0 2010-04-08 22:15:10 UTC 2019-11-26 03:19:15 UTC FDB020655 3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal Production by injured peel of grapefruit (Citrus paradisi) and orange (Citrus sinensis). 3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal is found in citrus. 3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal 4-Hydroxy-3-prenylcinnamaldehyde C14H16O2 216.2756 216.115029756 (2E)-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-enal (2E)-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-enal CC(C)=CCC1=C(O)C=CC(\C=C\C=O)=C1 InChI=1S/C14H16O2/c1-11(2)5-7-13-10-12(4-3-9-15)6-8-14(13)16/h3-6,8-10,16H,7H2,1-2H3/b4-3+ FNDJBOATFIWAJR-ONEGZZNKSA-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 1-hydroxy-2-unsubstituted benzenoids Aldehydes Enals Hydrocarbon derivatives Organic oxides Styrenes 1-hydroxy-2-unsubstituted benzenoid 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 Phenol Styrene logp 3.55 ALOGPS logs -4.10 ALOGPS solubility 1.70e-02 g/l ALOGPS melting_point Mp 144.5-146° logp 3.4 ChemAxon pka_strongest_acidic 8.85 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac (2E)-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-enal ChemAxon average_mass 216.2756 ChemAxon mono_mass 216.115029756 ChemAxon smiles CC(C)=CCC1=C(O)C=CC(\C=C\C=O)=C1 ChemAxon formula C14H16O2 ChemAxon inchi InChI=1S/C14H16O2/c1-11(2)5-7-13-10-12(4-3-9-15)6-8-14(13)16/h3-6,8-10,16H,7H2,1-2H3/b4-3+ ChemAxon inchikey FNDJBOATFIWAJR-ONEGZZNKSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 68.36 ChemAxon polarizability 24.85 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18823 Specdb::CMs 46991 Specdb::CMs 151890 Specdb::MsMs 307825 Specdb::MsMs 307826 Specdb::MsMs 307827 Specdb::MsMs 351868 Specdb::MsMs 351869 Specdb::MsMs 351870 Specdb::MsMs 2700004 Specdb::MsMs 2700005 Specdb::MsMs 2700006 Specdb::MsMs 3004839 Specdb::MsMs 3004840 Specdb::MsMs 3004841 HMDB40833 #<Reference:0x000055ce32075110> Citrus Unknown generic