U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H6N2O3
Molecular Weight 166.1341
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYL-2-NITRO-1-NITROSOBENZENE

SMILES

CC1=CC=C(N=O)C(=C1)[N+]([O-])=O

InChI

InChIKey=UORRERBFSRQJHQ-UHFFFAOYSA-N
InChI=1S/C7H6N2O3/c1-5-2-3-6(8-10)7(4-5)9(11)12/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula C7H6N2O3
Molecular Weight 166.1341
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 Tue Apr 01 20:02:16 GMT 2025
Edited
by admin
on Tue Apr 01 20:02:16 GMT 2025
Record UNII
F8LJ6RFA6J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-405250
Preferred Name English
4-METHYL-2-NITRO-1-NITROSOBENZENE
Systematic Name English
BENZENE, 4-METHYL-2-NITRO-1-NITROSO-
Systematic Name English
NSC-66501
Code English
Code System Code Type Description
EPA CompTox
DTXSID7064526
Created by admin on Tue Apr 01 20:02:16 GMT 2025 , Edited by admin on Tue Apr 01 20:02:16 GMT 2025
PRIMARY
NSC
66501
Created by admin on Tue Apr 01 20:02:16 GMT 2025 , Edited by admin on Tue Apr 01 20:02:16 GMT 2025
PRIMARY
FDA UNII
F8LJ6RFA6J
Created by admin on Tue Apr 01 20:02:16 GMT 2025 , Edited by admin on Tue Apr 01 20:02:16 GMT 2025
PRIMARY
PUBCHEM
81434
Created by admin on Tue Apr 01 20:02:16 GMT 2025 , Edited by admin on Tue Apr 01 20:02:16 GMT 2025
PRIMARY
NSC
405250
Created by admin on Tue Apr 01 20:02:16 GMT 2025 , Edited by admin on Tue Apr 01 20:02:16 GMT 2025
PRIMARY
CAS
6971-33-1
Created by admin on Tue Apr 01 20:02:16 GMT 2025 , Edited by admin on Tue Apr 01 20:02:16 GMT 2025
PRIMARY