Chem
J-GLOBAL ID：200907097176770302   Nikkaji number：J697.738C

4,4′-NNO-Azoxybis(2,6-dinitrotoluene)

2,2′,6,6′-テトラニトロ-4,4′-アゾキシトルエン
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： C14H10N[N+]5O4[O-]5
Molecular formula furigana： C14-H10-N6-O9
Molecular weight： 406.267
InChI： InChI=1S/C14H10N6O9/c1-7-11(17(22)23)3-9(4-12(7)18(24)25)15-16(21)10-5-13(19(26)27)8(2)14(6-10)20(28)29/h3-6H,1-2H3
InChI key： JZBHIQAXJAFHNP-UHFFFAOYSA-N
SMILES： Cc1c(cc(cc1[N+](=O)[O-])N=[N+]([O-])c1cc(c(C)c(c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Systematic name  (6)：
  • 4,4′-ジメチル-3,3′,5,5′-テトラニトロアゾキシベンゼン
  • 3,3′,5,5′-テトラニトロ-4,4′-ジメチルアゾキシベンゼン
  • 4,4′-NNO-アゾキシビス(2,6-ジニトロトルエン)
  • 1,2-ビス(4-メチル-3,5-ジニトロフェニル)ジアゼン1-オキシド
  • 4-メチル-N-[(4-メチル-3,5-ジニトロフェニル)イミノ]-3,5-ジニトロベンゼン-1-イミン オキシド
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Other name (6)：
  • 4,4′-Dimethyl-3,3′,5,5′-tetranitroazoxybenzene
  • 3,3′,5,5′-Tetranitro-4,4′-dimethylazoxybenzene
  • 4,4′-NNO-Azoxybis(2,6-dinitrotoluene)
  • 1,2-Bis(4-methyl-3,5-dinitrophenyl)diazene 1-oxide
  • 2,2′,6,6′-Tetranitro-4,4′-azoxytoluene
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CAS registry number： 51857-25-1
KEGG COMPOUND： C16413
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