1.0 2010-04-08 22:15:43 UTC 2018-05-29 01:51:25 UTC FDB021463 4-Isopropylphenylacetaldehyde It is used in perfumery and food flavouring (P-Isopropylphenyl)-acetaldehyde 4-(1-Methylethyl)-benzeneacetaldehyde 4-(1-Methylethyl)benzeneacetaldehyde 4-(1-Methylethyl)benzeneacetaldehyde, 9CI 4-Isopropyl phenylacetaldehyde Acetaldehyde, (p-isopropylphenyl)- Benzeneacetaldehyde, 4-(1-methylethyl)- Cortexal Cuminic acetaldehyde Cumyl acetaldehyde Cumylacetaldehyde FEMA 2954 Homocuminic aldehyde Isopropylphenylacetaldehyde, p- p-Cymene-7-carboxaldehyde p-Cymene-7-carboxaldehyde, 8CI P-isopropylphenylacetaldehyde C11H14O 162.2283 162.10446507 2-[4-(propan-2-yl)phenyl]acetaldehyde 4-isopropyl phenylacetaldehyde 4395-92-0 CC(C)C1=CC=C(CC=O)C=C1 InChI=1S/C11H14O/c1-9(2)11-5-3-10(4-6-11)7-8-12/h3-6,8-9H,7H2,1-2H3 FSKGFRBHGXIDSA-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 Phenylacetaldehydes 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 Phenylacetaldehyde Phenylpropane logp 3.18 ALOGPS logs -3.27 ALOGPS solubility 8.63e-02 g/l ALOGPS logp 2.7 ChemAxon pka_strongest_acidic 15.09 ChemAxon pka_strongest_basic -7 ChemAxon iupac 2-[4-(propan-2-yl)phenyl]acetaldehyde ChemAxon average_mass 162.2283 ChemAxon mono_mass 162.10446507 ChemAxon smiles CC(C)C1=CC=C(CC=O)C=C1 ChemAxon formula C11H14O ChemAxon inchi InChI=1S/C11H14O/c1-9(2)11-5-3-10(4-6-11)7-8-12/h3-6,8-9H,7H2,1-2H3 ChemAxon inchikey FSKGFRBHGXIDSA-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 50.63 ChemAxon polarizability 18.99 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21877 Specdb::CMs 169276 Specdb::MsIr 9270 Specdb::MsIr 9271 Specdb::MsMs 57975 Specdb::MsMs 57976 Specdb::MsMs 57977 Specdb::MsMs 113802 Specdb::MsMs 113803 Specdb::MsMs 113804 Specdb::MsMs 2466776 Specdb::MsMs 2466777 Specdb::MsMs 2466778 Specdb::MsMs 2496179 Specdb::MsMs 2496180 Specdb::MsMs 2496181 HMDB41493 #<Reference:0x000055ce31a53908> aldehydic cortex cumin earthy fern green