Chem
J-GLOBAL ID：200907018171263111   Nikkaji number：J934.116A

4,4′-Dithiobis(2-nitrobenzoic acid)

4,4′-ジチオビス(2-ニトロ安息香酸)
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： C14H8[N+]2O6[O-]2S2
Molecular formula furigana： C14-H8-N2-O8-S2
Molecular weight： 396.340
InChI： InChI=1S/C14H8N2O8S2/c17-13(18)9-3-1-7(5-11(9)15(21)22)25-26-8-2-4-10(14(19)20)12(6-8)16(23)24/h1-6H,(H,17,18)(H,19,20)
InChI key： WSXPIKRILJSZJJ-UHFFFAOYSA-N
SMILES： OC(=O)c1ccc(SSc2ccc(C(=O)O)c(c2)[N+](=O)[O-])cc1[N+](=O)[O-]
Systematic name  (4)：
  • 4,4′-ジチオビス(2-ニトロ安息香酸)
  • 4,4′-ジチオビス(6-ニトロ安息香酸)
  • 4-[(4-カルボキシ-3-ニトロフェニル)ジスルファニル]-2-ニトロ安息香酸
  • 4-[(4-carboxy-3-nitrophenyl)disulfanyl]-2-nitrobenzoic acid
Other name (2)：
  • 4,4′-Dithiobis(2-nitrobenzoic acid)
  • 4,4′-Dithiobis(6-nitrobenzoic acid)
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