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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4ClN
Molecular Weight 137.566
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLOROBENZONITRILE

SMILES

ClC1=CC=C(C=C1)C#N

InChI

InChIKey=GJNGXPDXRVXSEH-UHFFFAOYSA-N
InChI=1S/C7H4ClN/c8-7-3-1-6(5-9)2-4-7/h1-4H

HIDE SMILES / InChI

Molecular Formula C7H4ClN
Molecular Weight 137.566
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
The methoxycarbonylation of aryl chlorides catalysed by palladium complexes of bis(di-tert-butylphosphinomethyl)benzene.
2005 May 21
Characterisation of the substrate specificity of the nitrile hydrolyzing system of the acidotolerant black yeast Exophiala oligosperma R1.
2008
4-Chloro-benzothio-amide.
2009 Apr 25
5-(4-Chloro-phen-yl)-1H-tetra-zole.
2010 Mar 3
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:54:43 UTC 2023
Edited
by admin
on Sat Dec 16 05:54:43 UTC 2023
Record UNII
4Z0HGP3A8A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLOROBENZONITRILE
Systematic Name English
BENZONITRILE, 4-CHLORO-
Systematic Name English
BENZONITRILE, P-CHLORO-
Common Name English
NSC-6111
Code English
1-CHLORO-4-BENZONITRILE
Common Name English
P-CHLOROCYANOBENZENE
Common Name English
4-CYANOPHENYL CHLORID
Common Name English
1-CYANO-4-CHLOROBENZENE
Systematic Name English
P-CYANOCHLOROBENZENE
Common Name English
P-CHLOROBENZONITRILE
Common Name English
1-CHLORO-4-CYANOBENZENE
Systematic Name English
Code System Code Type Description
FDA UNII
4Z0HGP3A8A
Created by admin on Sat Dec 16 05:54:43 UTC 2023 , Edited by admin on Sat Dec 16 05:54:43 UTC 2023
PRIMARY
EPA CompTox
DTXSID8044703
Created by admin on Sat Dec 16 05:54:43 UTC 2023 , Edited by admin on Sat Dec 16 05:54:43 UTC 2023
PRIMARY
PUBCHEM
12163
Created by admin on Sat Dec 16 05:54:43 UTC 2023 , Edited by admin on Sat Dec 16 05:54:43 UTC 2023
PRIMARY
ECHA (EC/EINECS)
210-765-4
Created by admin on Sat Dec 16 05:54:43 UTC 2023 , Edited by admin on Sat Dec 16 05:54:43 UTC 2023
PRIMARY
NSC
6111
Created by admin on Sat Dec 16 05:54:43 UTC 2023 , Edited by admin on Sat Dec 16 05:54:43 UTC 2023
PRIMARY
CAS
623-03-0
Created by admin on Sat Dec 16 05:54:43 UTC 2023 , Edited by admin on Sat Dec 16 05:54:43 UTC 2023
PRIMARY
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