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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 2-Chlorobenzonitrile

SMILES

ClC1=CC=CC=C1C#N

InChI

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

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:03:11 GMT 2023
Edited
by admin
on Sat Dec 16 11:03:11 GMT 2023
Record UNII
C8Z5NE7QXJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Chlorobenzonitrile
Systematic Name English
NSC-8438
Code English
Benzonitrile, 2-chloro-
Systematic Name English
Code System Code Type Description
NSC
8438
Created by admin on Sat Dec 16 11:03:11 GMT 2023 , Edited by admin on Sat Dec 16 11:03:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
212-836-5
Created by admin on Sat Dec 16 11:03:11 GMT 2023 , Edited by admin on Sat Dec 16 11:03:11 GMT 2023
PRIMARY
FDA UNII
C8Z5NE7QXJ
Created by admin on Sat Dec 16 11:03:11 GMT 2023 , Edited by admin on Sat Dec 16 11:03:11 GMT 2023
PRIMARY
CAS
873-32-5
Created by admin on Sat Dec 16 11:03:11 GMT 2023 , Edited by admin on Sat Dec 16 11:03:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID5052593
Created by admin on Sat Dec 16 11:03:11 GMT 2023 , Edited by admin on Sat Dec 16 11:03:11 GMT 2023
PRIMARY
PUBCHEM
13391
Created by admin on Sat Dec 16 11:03:11 GMT 2023 , Edited by admin on Sat Dec 16 11:03:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY