HGMMX

3,4-Dinitrotoluene

Type: Other
PubChem: 11883
DrugBank: None
IUPAC: 4-methyl-1,2-dinitrobenzene
Standard InChI: InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3
Standard InChIKey: INYDMNPNDHRJQJ-UHFFFAOYSA-N
SMILES: CC1=CC=C([N+](=O)[O-])C([N+](=O)[O-])=C1
Metabolism-related information: Increase toxicity (may involved in carcinogenicity)
Reference: 10.1248/cpb.32.4070

Metabolites

Chemical Structure Metablite's name Reaction name Genus Species Reference
5-Methyl-2-nitroanilineReductionEscherichiacoli10.1248/cpb.32.4070