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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4N2O2
Molecular Weight 148.1189
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-NITROBENZONITRILE

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C#N

InChI

InChIKey=NKJIFDNZPGLLSH-UHFFFAOYSA-N
InChI=1S/C7H4N2O2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H

HIDE SMILES / InChI

Molecular Formula C7H4N2O2
Molecular Weight 148.1189
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 Mon Mar 31 22:01:09 GMT 2025
Edited
by admin
on Mon Mar 31 22:01:09 GMT 2025
Record UNII
4QKT535WUA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-NITROBENZONITRILE
Systematic Name English
NSC-5383
Preferred Name English
BENZONITRILE, 4-NITRO-
Common Name English
1-CYANO-4-NITROBENZENE
Common Name English
BENZONITRILE, P-NITRO-
Common Name English
P-NITROBENZONITRILE
Common Name English
4-CYANO-1-NITROBENZENE
Common Name English
P-CYANONITROBENZENE
Common Name English
4-CYANONITROBENZENE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID7060706
Created by admin on Mon Mar 31 22:01:09 GMT 2025 , Edited by admin on Mon Mar 31 22:01:09 GMT 2025
PRIMARY
NSC
5383
Created by admin on Mon Mar 31 22:01:09 GMT 2025 , Edited by admin on Mon Mar 31 22:01:09 GMT 2025
PRIMARY
PUBCHEM
12090
Created by admin on Mon Mar 31 22:01:09 GMT 2025 , Edited by admin on Mon Mar 31 22:01:09 GMT 2025
PRIMARY
ECHA (EC/EINECS)
210-610-0
Created by admin on Mon Mar 31 22:01:09 GMT 2025 , Edited by admin on Mon Mar 31 22:01:09 GMT 2025
PRIMARY
CAS
619-72-7
Created by admin on Mon Mar 31 22:01:09 GMT 2025 , Edited by admin on Mon Mar 31 22:01:09 GMT 2025
PRIMARY
FDA UNII
4QKT535WUA
Created by admin on Mon Mar 31 22:01:09 GMT 2025 , Edited by admin on Mon Mar 31 22:01:09 GMT 2025
PRIMARY