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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7N
Molecular Weight 117.1479
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLACETONITRILE

SMILES

N#CCC1=CC=CC=C1

InChI

InChIKey=SUSQOBVLVYHIEX-UHFFFAOYSA-N
InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2

HIDE SMILES / InChI

Molecular Formula C8H7N
Molecular Weight 117.1479
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Isolation and characterization of a bacterium possessing a novel aldoxime-dehydration activity and nitrile-degrading enzymes.
1998 Aug
Juvenile-hormone-mediated plasticity of aggregation behaviour and olfactory processing in adult desert locusts.
2001 Jan
(n-Nitrophenyl)acetonitrile, with n = 2, 3 and 4.
2002 Aug
Antiaphrodisiacs in pierid butterflies: a theme with variation!
2003 Jun
Chemical communication: butterfly anti-aphrodisiac lures parasitic wasps.
2005 Feb 17
Glycine conjugates in a lepidopteran insect herbivore--the metabolism of benzylglucosinolate in the cabbage white butterfly, Pieris rapae.
2006 Dec
Purification and characterization of an enantioselective arylacetonitrilase from Pseudomonas putida.
2006 Feb
Reactivity study of a hydroperoxodicopper(II) complex: hydroxylation, dehydrogenation, and ligand cross-link reactions.
2006 Sep 4
The discovery and mechanism of action of letrozole.
2007
Ozone degrades common herbivore-induced plant volatiles: does this affect herbivore prey location by predators and parasitoids?
2007 Apr
Isolation and characterization of a nitrile hydrolysing acidotolerant black yeast-Exophiala oligosperma R1.
2007 Jun
(1-Acetyl-2,6-diphenyl-piperidin-4-yl-idene)(phen-yl)acetonitrile.
2008 Apr 4
A new nitrilase from Bradyrhizobium japonicum USDA 110. Gene cloning, biochemical characterization and substrate specificity.
2008 Feb 1
Electronic and vibrational spectroscopic investigation of phenylacetylene-amine complexes. Evidence for the diversity in the intermolecular structures.
2008 May 15
Utilization of arylaliphatic nitriles by haloalkaliphilic Halomonas nitrilicus sp. nov. isolated from soda soils.
2008 Nov
A new synthetic route to 3-oxo-4-amino-1,2,3-oxadiazole from the diazeniumdiolation of benzyl cyanide: stable sydnone iminium N-oxides.
2009 Feb 20
Reductions of aliphatic and aromatic nitriles to primary amines with diisopropylaminoborane.
2009 Mar 6
2,5-Diphenyl-penta-2,4-dienenitrile.
2009 Oct 31
Ochratoxin A and aflatoxins in liquorice products.
2010 Apr
Biocatalytic synthesis of (R)-(-)-mandelic acid from racemic mandelonitrile by cetyltrimethylammonium bromide-permeabilized cells of Alcaligenes faecalis ECU0401.
2010 Jul
2-[(2Z,3E)-2-Hy-droxy-imino-5-phenyl-2,3-dihydro-3-thienyl-idene]-2-phenyl-acetonitrile.
2010 Jul 7
Present or past herbivory: a screening of volatiles released from Brassica rapa under caterpillar attacks as attractants for the solitary parasitoid, Cotesia vestalis.
2010 Jun
Chemical ecology of obligate pollination mutualisms: testing the 'private channel' hypothesis in the Breynia-Epicephala association.
2010 Jun
Stereodivergent quaternization of 2-alkyl-2-p-tolylsulfinylacetonitriles: NMR spectroscopic evidence of planar and pyramidal benzylic carbanions.
2010 Jun 1
Synthesis, characterization, photophysical, and anion-binding studies of luminescent heteroleptic bis-tridentate ruthenium(II) complexes based on 2,6-bis(benzimidazole-2-yl)pyridine and 4'-substituted 2,2':6',2'' terpyridine derivatives.
2010 Jun 7
1,5-Dicyano-anthraquinone.
2010 Mar 6
Volatile composition screening of Salix spp. nectar honey: benzenecarboxylic acids, norisoprenoids, terpenes, and others.
2010 Sep
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:47:28 GMT 2023
Edited
by admin
on Fri Dec 15 17:47:28 GMT 2023
Record UNII
23G40PRP93
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENYLACETONITRILE
Systematic Name English
BENZYL CYANIDE [HSDB]
Common Name English
TRIAMTERENE IMPURITY D [EP IMPURITY]
Common Name English
BENZYL CYANIDE
HSDB   MI  
Systematic Name English
NSC-118418
Code English
BENZYL CYANIDE [MI]
Common Name English
Classification Tree Code System Code
DEA NO. 8735
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
Code System Code Type Description
HSDB
2103
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
PUBCHEM
8794
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID2021492
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
MERCK INDEX
m2404
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
205-410-5
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
NSC
118418
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
MESH
C006725
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
CHEBI
25979
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
CAS
140-29-4
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
FDA UNII
23G40PRP93
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
WIKIPEDIA
BENZYL CYANIDE
Created by admin on Fri Dec 15 17:47:28 GMT 2023 , Edited by admin on Fri Dec 15 17:47:28 GMT 2023
PRIMARY
Related Record Type Details
IMPURITY -> PARENT
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (GC)
EP