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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H3N3O6
Molecular Weight 213.1045
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3-TRINITROBENZENE

SMILES

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

InChI

InChIKey=ONOWMDPHGJEBAZ-UHFFFAOYSA-N
InChI=1S/C6H3N3O6/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15/h1-3H

HIDE SMILES / InChI

Approval Year

Name Type Language
BENZENE, 1,2,3-TRINITRO-
Preferred Name English
1,2,3-TRINITROBENZENE
Common Name English
Code System Code Type Description
CHEBI
48114
Created by admin on Wed Apr 02 13:19:14 GMT 2025 , Edited by admin on Wed Apr 02 13:19:14 GMT 2025
PRIMARY
FDA UNII
SPX6MW5XHL
Created by admin on Wed Apr 02 13:19:14 GMT 2025 , Edited by admin on Wed Apr 02 13:19:14 GMT 2025
PRIMARY
CAS
603-13-4
Created by admin on Wed Apr 02 13:19:14 GMT 2025 , Edited by admin on Wed Apr 02 13:19:14 GMT 2025
PRIMARY
EPA CompTox
DTXSID40209050
Created by admin on Wed Apr 02 13:19:14 GMT 2025 , Edited by admin on Wed Apr 02 13:19:14 GMT 2025
PRIMARY
WIKIPEDIA
1,2,3-Trinitrobenzene
Created by admin on Wed Apr 02 13:19:14 GMT 2025 , Edited by admin on Wed Apr 02 13:19:14 GMT 2025
PRIMARY
PUBCHEM
521922
Created by admin on Wed Apr 02 13:19:14 GMT 2025 , Edited by admin on Wed Apr 02 13:19:14 GMT 2025
PRIMARY