Chem
J-GLOBAL ID：200907085151717298   Nikkaji number：J1.209B

1,2-Dinitrobenzene

1,2-ジニトロベンゼン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C6H4[N+]2O2[O-]2
Molecular formula furigana： C6-H4-N2-O4
Molecular weight： 168.108
InChI： InChI=1S/C6H4N2O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H
InChI key： IZUKQUVSCNEFMJ-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccccc1[N+](=O)[O-]
Systematic name  (3)：
  • 1,2-ジニトロベンゼン
  • 1-ニトロ-2-ニトロベンゼン
  • 1,2-dinitrobenzene
Other name (4)：
  • o-ジニトロベンゼン
  • o-Dinitrobenzene
  • 1,2-Dinitrobenzene
  • 1-Nitro-2-nitrobenzene
CAS registry number： 528-29-0
Regulation number (5)：
  • EINECS2084318
  • (3)-445
  • CZ7450000
  • UN-1597
  • UN-3443
KEGG COMPOUND： C14702
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