Chem
J-GLOBAL ID:200907069265856365   Nikkaji number:J923.389J

4DTBP-6,8

4DTBP-6,8
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: C32H54[N+]2S2
Molecular formula furigana: C32-H54-N2-S2
Molecular weight: 530.920
InChI: InChI=1S/C32H54N2S2/c1-3-5-7-9-11-15-23-33-25-19-31(20-26-33)35-29-17-13-14-18-30-36-32-21-27-34(28-22-32)24-16-12-10-8-6-4-2/h19-22,25-28H,3-18,23-24,29-30H2,1-2H3/q+2
InChI key: IJBRTYNXXVWRHM-UHFFFAOYSA-N
SMILES: CCCCCCCC[n+]1ccc(SCCCCCCSc2cc[n+](CCCCCCCC)cc2)cc1
Systematic name  (6):
  • 4,4′-(ヘキサメチレンビスチオ)ビス(1-オクチルピリジニウム)
  • 4,4′-[ヘキサメチレンビス(チオ)]ビス(1-オクチルピリジニウム)
  • 4,4′-[ヘキサメチレンビスチオ]ビス(1-オクチルピリジニウム)
  • 4,4′-(1,6-ヘキサンジイルビスチオ)ビス(1-オクチルピリジニウム)
  • 1-オクチル-4-({6-[(1-オクチルピリジン-1-イウム-4-イル)スルファニル]ヘキシル}スルファニル)ピリジン-1-イウム
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Other name (5):
  • 4,4′-(Hexamethylenebisthio)bis(1-octylpyridinium)
  • 4,4′-[Hexamethylenebis(thio)]bis(1-octylpyridinium)
  • 4,4′-[Hexamethylenebisthio]bis(1-octylpyridinium)
  • 4,4′-(1,6-Hexanediylbisthio)bis(1-octylpyridinium)
  • 4DTBP-6,8
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