Identification

Namephenyl propionaldehyde
CAS Number1335-10-0
EINECS215-620-9
FDA UNIILP1E86N30T
Molecular FormulaC9 H10 O
Molecular Weight134.17790000
MDL NumberMFCD00007021
Nikkaji NumberJ36.950K
Beilstein1071910
XlogP31.30 (est)

Regulatory

Physical Properties

Appearance colorless to pale yellow clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 217.00 to 218.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure 0.131000 mmHg @ 25.00 °C. (est)
Flash Point 203.00 °F. TCC ( 95.00 °C. ) (est)
logP (o/w) 1.780 (est)
Soluble in alcohol
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

No sensory data available

Safety Information

Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryfragrance agents
RIFM Fragrance Material Safety AssessmentSearch
Recommendation for phenyl propionaldehyde flavor usage levels up tonot for flavor use.

No supplier data available

Potential Uses

None Found

Natural Occurrence

beer PMC cassia bark cassia leaf champaca concrete @ trace% Data cheese gruyere cheese PMC cinnamon bark oil (cinnamomum zeylanicum) sri lauka @ 0.10-0.70% Data cinnamon ceylon cinnamon bark cinnamon ceylon cinnamon leaf cinnamon ceylon cinnamon root bark strawberry wild strawberry fruit tomato fruit

Synonyms

dihydrocinnamaldehyde hydrocinnamic aldehyde hydrocinnamyl aldehyde hydrocinnamylaldehyde phenyl propanal 3- phenylpropanal phenylpropionaldehyde propionaidehyde, phenyl- PubMed: Formation of complex natural flavours by biotransformation of apple pomace with basidiomycetes. PubMed: From a remarkable manifestation of polar effects in a radical fragmentation to the convergent synthesis of highly functionalized ketones. PubMed: Rh-catalyzed linear hydroformylation of styrene. PubMed: Enhancement of the promiscuous aldolase and dehydration activities of 4-oxalocrotonate tautomerase by protein engineering. PubMed: Characterization and further stabilization of a new anti-prelog specific alcohol dehydrogenase from Thermus thermophilus HB27 for asymmetric reduction of carbonyl compounds. PubMed: A computational reinvestigation of the formation of N-alkylpyrroles via intermolecular redox amination. PubMed: In vivo cytokine modulatory effects of cinnamaldehyde, the major constituent of leaf essential oil from Cinnamomum osmophloeum Kaneh. PubMed: A site-saturated mutagenesis study of pentaerythritol tetranitrate reductase reveals that residues 181 and 184 influence ligand binding, stereochemistry and reactivity. PubMed: Well-defined N-heterocyclic carbene silver halides of 1-cyclohexyl-3-arylmethylimidazolylidenes: synthesis, structure and catalysis in A3-reaction of aldehydes, amines and alkynes. PubMed: Formation of multi-stereogenic centers using a catalytic diastereoselective Henry reaction. PubMed: Olfactory sensitivity for sperm-attractant aromatic aldehydes: a comparative study in human subjects and spider monkeys. PubMed: Origin of pressure effects on regioselectivity and enantioselectivity in the rhodium-catalyzed hydroformylation of styrene with (S,S,S)-BisDiazaphos. PubMed: The development and evaluation of a conducting matrix for the electrochemical regeneration of the immobilised co-factor NAD(H) under continuous flow. PubMed: Emission pattern of semi-volatile organic compounds from recycled styrenic polymers using headspace solid-phase microextraction gas chromatography-mass spectrometry. PubMed: Halonium ion-assisted deiodination of styrene-based vicinal iodohydrins followed by rearrangement through phenyl migration. PubMed: Antimicrobial activity of the essential oil obtained from roots and chemical composition of the volatile constituents from the roots, stems, and leaves of Ballota nigra from Serbia. PubMed: Substrate specificity of human and yeast aldehyde dehydrogenases. PubMed: Purification and characterization of aldehyde dehydrogenase with a broad substrate specificity originated from 2-phenylethanol-assimilating Brevibacterium sp. KU1309. PubMed: Mechanistic and structural studies of apoform, binary, and ternary complexes of the Arabidopsis alkenal double bond reductase At5g16970. PubMed: Pinus taeda phenylpropenal double-bond reductase: purification, cDNA cloning, heterologous expression in Escherichia coli, and subcellular localization in P. taeda. PubMed: Stability and comparative metabolism of selected felbamate metabolites and postulated fluorofelbamate metabolites by postmitochondrial suspensions. PubMed: Oxidative aldehyde deformylation catalyzed by NADPH-cytochrome P450 reductase and the flavoprotein domain of neuronal nitric oxide synthase. PubMed: Can the pi-facial selectivity of solvation be predicted by atomistic simulation? PubMed: Inversion of stereoselectivity by applying mutants of the hydroxynitrile lyase from Manihot esculenta. PubMed: Strategy for the synthesis of polymeric supports with hydrazone linkers for solid-phase alkylation of ketones and aldehydes. PubMed: Investigating the role of 2-phenylpropenal in felbamate-induced idiosyncratic drug reactions. PubMed: Enantioselective catalysis of the hetero-Diels-Alder reaction between Brassard's diene and aldehydes by hydrogen-bonding activation: a one-step synthesis of (S)-(+)-dihydrokawain. PubMed: Development of highly diastereo- and enantioselective direct asymmetric aldol reaction of a glycinate Schiff base with aldehydes catalyzed by chiral quaternary ammonium salts. PubMed: Reversal of enantioselectivity in the hydroformylation of styrene with [2S,4S-BDPP]Pt(SnCl3)Cl at high temperature arises from a change in the enantioselective-determining step. PubMed: Cumene oxidation by cis-[RuIV(bpy)2(py)(O)]2+, revisited. PubMed: Chiral aldehydes in hydrocarbons: diastereoselective nucleophilic addition, NMR, and CD spectroscopy reveal dynamic solvation effects. PubMed: The arduous way to the egg: follow the nose. PubMed: SuperQuat N-acyl-5,5-dimethyloxazolidin-2-ones for the asymmetric synthesis of alpha-alkyl and beta-alkyl aldehydes. PubMed: Total synthesis of (+)-strictifolione. PubMed: Reductive activation of dioxygen by a myoglobin reconstituted with a flavohemin. PubMed: High yield synthesis of nitriles by a new enzyme, phenylacetaldoxime dehydratase, from Bacillus sp. strain OxB-1. PubMed: Diastereoselective inter- and intramolecular pinacol coupling of aldehydes promoted by monomeric titanocene(II) complex Cp(2)TiPh. PubMed: Felkin-Anh stereoselectivity in cycloadditions of acetylketene: evidence for a concerted, pseudopericyclic pathway PubMed: Stopped-flow spectrophotometric analysis of intermediates in the peroxo-dependent inactivation of cytochrome P450 by aldehydes. PubMed: EPR spectrometry of cytochrome P450 2B4: effects of mutations and substrate binding. PubMed: Catalysis by amino acid-derived tetracoordinate complexes: enantioselective addition of dialkylzincs to aliphatic and aromatic aldehydes. PubMed: First asymmetric synthesis of a 6-alkoxy-5,6-dihydro-1,3-oxazine: a promising enantioselective route to beta-amido aldehydes PubMed: The synthesis, in vitro reactivity, and evidence for formation in humans of 5-phenyl-1,3-oxazinane-2,4-dione, a metabolite of felbamate. PubMed: Discrete species of activated oxygen yield different cytochrome P450 heme adducts from aldehydes. PubMed: Synthesis and cytotoxic activity of N-substituted thiosemicarbazones of 3-(3,4-methylenedioxy)phenylpropanal. PubMed: Mechanism-based inactivation of cytochrome P450 2B4 by aldehydes: relationship to aldehyde deformylation via a peroxyhemiacetal intermediate. PubMed: Asymmetric Electroreduction of Ketone and Aldehyde Derivatives to the Corresponding Alcohols Using Alcohol Dehydrogenase as an Electrocatalyst. PubMed: Identification of modified atropaldehyde mercapturic acids in rat and human urine after felbamate administration. PubMed: Synthesis and in vitro reactivity of 3-carbamoyl-2-phenylpropionaldehyde and 2-phenylpropenal: putative reactive metabolites of felbamate. PubMed: Hepatic microsomal oxygenation of aldehydes to carboxylic acids. PubMed: Metabolic conversion of 2-propylpentanal acetals to valproic acid in vitro. Model prodrugs of carboxylic acid agents. PubMed: Reductions of 2-enals, dehydrogenation of saturated aldehydes and their racemisation. PubMed: Geometric specificity of alcohol dehydrogenases and its potential for separation of trans and cis isomers of unsaturated aldehydes. PubMed: Nicotinamide adenine dinucleotide phosphate-decanaldehyde adduct as an inhibitor of beef brain NADP-linked aldehyde reductase. PubMed: Biosynthesis of mustard oil glucosides: conversion of phenylacetaldehyde oxime and 3-phenylpropionaldehyde oxime to glucotropaeolin and gluconasturtiin.