1.0 2010-04-08 22:11:36 UTC 2015-07-20 23:13:47 UTC FDB015025 3-(4-Isopropylphenyl)propanal Flavouring ingredient 3-(p-Cumenyl)propionaldehyde 3-(p-Isopropylphenyl)propionaldehyde 3-(p-Isopropylphenyl)propionaldeyde 3-P-Cumenyl-propionaldehyde 3-p-Cumenylpropionaldehyde 4-(1-Methylethyl)-benzenepropanal 4-(1-Methylethyl)benzenepropanal 4-(1-Methylethyl)benzenepropanal, 9CI Benzenepropanal, 4-(1-methylethyl)- Cuminacetaldehyde Cuminyl acetaldehyde Cymylpropanal, p- FEMA 2957 Hydrocinnamaldehyde, p-isopropyl- Isopropylhydrocinnamaldehyde, p- P-Cymylpropanal P-Isopropyl-hydrocinnamaldehyde P-Isopropylhydrocinnamaldehyde Propionaldehyde, 3-P-cumenyl- C12H16O 176.2548 176.120115134 3-[4-(propan-2-yl)phenyl]propanal 3-(4-isopropylphenyl)propanal 7775-00-0 CC(C)C1=CC=C(CCC=O)C=C1 InChI=1S/C12H16O/c1-10(2)12-7-5-11(6-8-12)4-3-9-13/h5-10H,3-4H2,1-2H3 RLEFOSDUWZYGOS-UHFFFAOYSA-N belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring. Aromatic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aromatic homomonocyclic compounds Alpha-hydrogen aldehydes Cumenes Hydrocarbon derivatives Monocyclic monoterpenoids Organic oxides Phenylpropanes Aldehyde Alpha-hydrogen aldehyde Aromatic homomonocyclic compound Aromatic monoterpenoid Benzenoid Carbonyl group Cumene Hydrocarbon derivative Monocyclic benzene moiety Monocyclic monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound P-cymene Phenylpropane logp 3.72 ALOGPS logs -3.88 ALOGPS solubility 2.33e-02 g/l ALOGPS logp 3.14 ChemAxon pka_strongest_acidic 15.3 ChemAxon pka_strongest_basic -7 ChemAxon iupac 3-[4-(propan-2-yl)phenyl]propanal ChemAxon average_mass 176.2548 ChemAxon mono_mass 176.120115134 ChemAxon smiles CC(C)C1=CC=C(CCC=O)C=C1 ChemAxon formula C12H16O ChemAxon inchi InChI=1S/C12H16O/c1-10(2)12-7-5-11(6-8-12)4-3-9-13/h5-10H,3-4H2,1-2H3 ChemAxon inchikey RLEFOSDUWZYGOS-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 55.23 ChemAxon polarizability 21.14 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24795 Specdb::CMs 137724 Specdb::CMs 145458 Specdb::MsIr 7139 Specdb::MsIr 7140 Specdb::MsMs 104460 Specdb::MsMs 104461 Specdb::MsMs 104462 Specdb::MsMs 170748 Specdb::MsMs 170749 Specdb::MsMs 170750 Specdb::MsMs 2376527 Specdb::MsMs 2376528 Specdb::MsMs 2376529 Specdb::MsMs 2562630 Specdb::MsMs 2562631 Specdb::MsMs 2562632 HMDB36171 #<Reference:0x000055ce31ee2460> floral fresh fruity melon muguet