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Details

Stereochemistry RACEMIC
Molecular Formula C9H10O
Molecular Weight 134.1751
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-PHENYLPROPANAL

SMILES

CC(C=O)C1=CC=CC=C1

InChI

InChIKey=IQVAERDLDAZARL-UHFFFAOYSA-N
InChI=1S/C9H10O/c1-8(7-10)9-5-3-2-4-6-9/h2-8H,1H3

HIDE SMILES / InChI

Molecular Formula C9H10O
Molecular Weight 134.1751
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Role of glutathione S-transferases A1-1, M1-1, and P1-1 in the detoxification of 2-phenylpropenal, a reactive felbamate metabolite.
2001 May
Reductive activation of dioxygen by a myoglobin reconstituted with a flavohemin.
2002 Sep 25
Cumene oxidation by cis-[RuIV(bpy)2(py)(O)]2+, revisited.
2004 Feb 23
Chiral aldehydes in hydrocarbons: diastereoselective nucleophilic addition, NMR, and CD spectroscopy reveal dynamic solvation effects.
2004 Jan
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.
2004 May 5
Inversion of stereoselectivity by applying mutants of the hydroxynitrile lyase from Manihot esculenta.
2005 Apr
Combinations of chiral and prochiral singlet radical-pairs in reaction cavities of polyethylene films. Control and analysis of radical tumbling and translation.
2005 Apr
Can the pi-facial selectivity of solvation be predicted by atomistic simulation?
2005 Aug 3
Loading-washout studies of the stereoselective sinusoidal uptake of (R)- and (s)-2-phenylpropionyl acyl glucuronide.
2006 Oct
Modifications of antiepileptic drugs for improved tolerability and efficacy.
2008 Feb 14
Substrate specificity of human and yeast aldehyde dehydrogenases.
2009 Mar 16
Halonium ion-assisted deiodination of styrene-based vicinal iodohydrins followed by rearrangement through phenyl migration.
2009 Oct 16
Origin of pressure effects on regioselectivity and enantioselectivity in the rhodium-catalyzed hydroformylation of styrene with (S,S,S)-BisDiazaphos.
2010 Aug 4
Emission pattern of semi-volatile organic compounds from recycled styrenic polymers using headspace solid-phase microextraction gas chromatography-mass spectrometry.
2010 Jan 15
The development and evaluation of a conducting matrix for the electrochemical regeneration of the immobilised co-factor NAD(H) under continuous flow.
2010 May 21
Formation of multi-stereogenic centers using a catalytic diastereoselective Henry reaction.
2010 Nov 14
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:53:52 GMT 2023
Edited
by admin
on Fri Dec 15 17:53:52 GMT 2023
Record UNII
8JKX55PKZQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PHENYLPROPANAL
Systematic Name English
HYACINTHAL
Common Name English
2-PHENYLPROPIONALDEHYDE [FHFI]
Common Name English
.ALPHA.-PHENYLPROPIONALDEHYDE
Systematic Name English
.ALPHA.-FORMYLETHYLBENZENE
Systematic Name English
(±)-2-PHENYLPROPANAL
Systematic Name English
NSC-5231
Code English
FEMA NO. 2886
Code English
HYDRATROPALDEHYDE
Systematic Name English
CUMENE ALDEHYDE
Systematic Name English
.ALPHA.-METHYLPHENYLACETALDEHYDE
Systematic Name English
2-PHENYLPROPIONALDEHYDE [FCC]
Common Name English
2-PHENYLPROPANALDEHYDE
Systematic Name English
(±)-.ALPHA.-PHENYLPROPIONALDEHYDE
Systematic Name English
(±)-HYDRATROPIC ALDEHYDE
Common Name English
(±)-2-PHENYLPROPIONALDEHYDE
Systematic Name English
BENZENEACETALDEHYDE, .ALPHA.-METHYL-
Systematic Name English
HYDRATROPIC ALDEHYDE
Common Name English
.ALPHA.-METHYLBENZENEACETALDEHYDE
Systematic Name English
.ALPHA.-METHYL-.ALPHA.-TOLUIC ALDEHYDE
Systematic Name English
2-PHENYLPROPIONALDEHYDE
FCC   FHFI  
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
JECFA EVALUATION 2-PHENYLPROPIONALDEHYDE
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
Code System Code Type Description
PUBCHEM
7146
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
JECFA MONOGRAPH
1455
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
MESH
C013026
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
NSC
5231
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
FDA UNII
8JKX55PKZQ
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
CHEBI
149463
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
CAS
93-53-8
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-255-5
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID0052629
Created by admin on Fri Dec 15 17:53:52 GMT 2023 , Edited by admin on Fri Dec 15 17:53:52 GMT 2023
PRIMARY