Substance
  • Substance Name: 3-nitrotoluene
  • Formula: C7H7NO2
  • Molecular Weight: 137.14 g/mol
  • Identifiers:
    • casrn: 99-08-1
    • pubchemId: 7422
    • iupacname: 1-methyl-3-nitrobenzene
    • inchi: InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
    • inchikey: QZYHIOPPLUPUJF-UHFFFAOYSA-N
    • csmiles: CC1=CC(=CC=C1)[N+](=O)[O-]
    • ismiles: CC1=CC(=CC=C1)[N+](=O)[O-]
    • wikidataId: Q2816005
    • chemspiderId: 21106146
    • dsstoxcmpId: DTXCID001831
    • chemblId: CHEMBL114059
    • ecnumber: 202-728-6
3-nitrotoluene
Systems and Datasets