U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8O
Molecular Weight 120.1485
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLACETALDEHYDE

SMILES

O=CCC1=CC=CC=C1

InChI

InChIKey=DTUQWGWMVIHBKE-UHFFFAOYSA-N
InChI=1S/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2

HIDE SMILES / InChI

Molecular Formula C8H8O
Molecular Weight 120.1485
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Insect odour perception: recognition of odour components by flower foraging moths.
2006-08-22
Plant phenylacetaldehyde synthase is a bifunctional homotetrameric enzyme that catalyzes phenylalanine decarboxylation and oxidation.
2006-08-18
Polymer supported vanadium and molybdenum complexes as potential catalysts for the oxidation and oxidative bromination of organic substrates.
2006-08-07
Critical aspects of the determination of pentafluorobenzyl derivatives of aldehydes by gas chromatography with electron-capture or mass spectrometric detection: Validation of an optimized strategy for the determination of oxygen-related odor-active aldehydes in wine.
2006-07-28
Identification of the key aroma compounds in cocoa powder based on molecular sensory correlations.
2006-07-26
Difference in the volatile composition of pine-mushrooms (Tricholoma matsutake Sing.) according to their grades.
2006-06-28
Volatile composition and contribution to the aroma of spanish honeydew honeys. Identification of a new chemical marker.
2006-06-28
Characterization of E. coli tetrameric aldehyde dehydrogenases with atypical properties compared to other aldehyde dehydrogenases.
2006-06
Reversible carbon-carbon bond formation between 1,3-dienes and aldehyde or ketone on nickel(0).
2006-05-31
Fragrance of Canada thistle (Cirsium arvense) attracts both floral herbivores and pollinators.
2006-05
Formation of strecker aldehydes from polyphenol-derived quinones and alpha-amino acids in a nonenzymic model system.
2006-03-08
Formation of amines and aldehydes from parent amino acids during thermal processing of cocoa and model systems: new insights into pathways of the strecker reaction.
2006-03-08
Synthesis, characterisation, reactivity and in vitro antiamoebic activity of hydrazone based oxovanadium(IV), oxovanadium(V) and mu-bis(oxo)bis{oxovanadium(V)} complexes.
2006-02-21
Proline-catalyzed, asymmetric mannich reactions in the synthesis of a DPP-IV inhibitor.
2006-01-06
Nursery pollination by a moth in Silene latifolia: the role of odours in eliciting antennal and behavioural responses.
2006
Strecker type degradation of phenylalanine by 4-hydroxy-2-nonenal in model systems.
2005-12-28
Electrophysiological and behavioral responses to chocolate volatiles in both sexes of the pyralid moths Ephestia cautella and Plodia interpunctella.
2005-12
1-Pentyl-3-phenylacetylindoles, a new class of cannabimimetic indoles.
2005-09-15
Controlled delivery of paclitaxel from stent coatings using poly(hydroxystyrene-b-isobutylene-b-hydroxystyrene) and its acetylated derivative.
2005-09-13
Automation of gene assignments to metabolic pathways using high-throughput expression data.
2005-08-31
Identification of characteristic aroma-active compounds from water dropwort (Oenanthe javanica DC.).
2005-08-24
In vivo antimuscarinic actions of the third generation antihistaminergic agent, desloratadine.
2005-08-18
Identification of potent odorants formed during the preparation of extruded potato snacks.
2005-08-10
Photochemical release of aldehydes from alpha-acetoxy nitroveratryl ethers.
2005-08-04
The FEMA GRAS assessment of phenethyl alcohol, aldehyde, acid, and related acetals and esters used as flavor ingredients.
2005-08
Phenylacetaldehyde oxidation by freshly prepared and cryopreserved guinea pig liver slices: the role of aldehyde oxidase.
2005-07-23
Strecker-type degradation of phenylalanine by methyl 9,10-epoxy-13-oxo-11-octadecenoate and methyl 12,13-epoxy-9-oxo-11-octadecenoate.
2005-06-01
Effects of styrene and its metabolites on different lung compartments of the mouse--cell proliferation and histomorphology.
2005-06
Chemistry of styrene (water)n clusters, n = 1-5: spectroscopy and structure of the neutral clusters, deprotonation of styrene dimer cation, and implication to the inhibition of cationic polymerization.
2005-05-26
Multistate reactivity in styrene epoxidation by compound I of cytochrome p450: mechanisms of products and side products formation.
2005-04-22
Characterization of aroma compounds responsible for the rosy/floral flavor in Cheddar cheese.
2005-04-20
Reactivity of titanium oxo ethoxo cluster [Ti16O16(OEt)32]. Versatile precursor of nanobuilding block-based hybrid materials.
2005-04-06
Aldol additions of dihydroxyacetone phosphate to N-Cbz-amino aldehydes catalyzed by L-fuculose-1-phosphate aldolase in emulsion systems: inversion of stereoselectivity as a function of the acceptor aldehyde.
2005-02-18
Synthesis, structure, and reactions of stable oxametallacycles from styrene oxide on Ag(111).
2005-02-17
N-Acyl arylsulfonamides as novel, reversible inhibitors of human steroid sulfatase.
2005-02-15
Floral scent emission and pollinator attraction in two species of Gymnadenia (Orchidaceae).
2005-02
Metabolism of 2-phenylethylamine to phenylacetic acid, via the intermediate phenylacetaldehyde, by freshly prepared and cryopreserved guinea pig liver slices.
2005-01-14
Phosphaallyl complexes of Ru(II) derived from dicyclohexylvinylphosphine (DCVP).
2005-01-07
Qualitative and quantitative analyses of flower scent in Silene latifolia.
2005-01
Fragile X protein functions with lgl and the par complex in flies and mice.
2005-01
Further insights into the role of methional and phenylacetaldehyde in lager beer flavor stability.
2004-12-29
Enzymatic oxidation of 2-phenylethylamine to phenylacetic acid and 2-phenylethanol with special reference to the metabolism of its intermediate phenylacetaldehyde.
2004-12
EAG and behavioral responses of Helicoverpa armigera males to volatiles from poplar leaves and their combinations with sex pheromone.
2004-12
Aroma compounds in sweet whey powder.
2004-12
Strecker-type degradation produced by the lipid oxidation products 4,5-epoxy-2-alkenals.
2004-11-17
Discrepancy between antennal and behavioral responses for enantiomers of alpha-pinene: electrophysiology and behavior of Helicoverpa armigera (Lepidoptera).
2004-10
Enhancement of attraction to sex pheromones of Spodoptera exigua by volatile compounds produced by host plants.
2004-10
Odorous products of the chlorination of phenylalanine in water: formation, evolution, and quantification.
2004-08-01
Optimization of a chemical attractant for Epicometis (Tropinota) hirta Poda.
2004-07-10
Metabolism of 2-phenylethylamine and phenylacetaldehyde by precision-cut guinea pig fresh liver slices.
2004-07-03
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 17:34:18 GMT 2025
Edited
by admin
on Mon Mar 31 17:34:18 GMT 2025
Record UNII
U8J5PLW9MR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-406309
Preferred Name English
PHENYLACETALDEHYDE
FCC   FHFI   MI  
Systematic Name English
PHENYLACETALDEHYDE [FHFI]
Common Name English
PHENYLACETALDEHYDE [FCC]
Common Name English
PHENYLACETALDEHYDE [MI]
Common Name English
FEMA NO. 2874
Common Name English
PHENYLETHANAL
Systematic Name English
OXOPHENYLETHANE
Systematic Name English
.ALPHA.-TOLUIC ALDEHYDE
Systematic Name English
BENZENEACETALDEHYDE
Systematic Name English
.ALPHA.-TOLUALDEHYDE
Systematic Name English
HYACINTHIN
Common Name English
ACETALDEHYDE, PHENYL-
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION PHENYLACETALDEHYDE
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
CFR 21 CFR 172.515
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
Code System Code Type Description
SMS_ID
100000138547
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
PUBCHEM
998
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
MERCK INDEX
m8647
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY Merck Index
MESH
C013192
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
CHEBI
16424
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
EVMPD
SUB78100
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
DAILYMED
U8J5PLW9MR
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
CAS
122-78-1
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
JECFA MONOGRAPH
935
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
DRUG BANK
DB02178
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
FDA UNII
U8J5PLW9MR
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
ECHA (EC/EINECS)
204-574-5
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
WIKIPEDIA
PHENYLACETALDEHYDE
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
RXCUI
1367159
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY RxNorm
EPA CompTox
DTXSID3021483
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
NSC
406309
Created by admin on Mon Mar 31 17:34:18 GMT 2025 , Edited by admin on Mon Mar 31 17:34:18 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT