Chem
J-GLOBAL ID:200907000033506198   Nikkaji number:J1.700.943E

4,4′-(2,5-Thiophenediyl)bis(1-hexadecylpyridinium)

4,4′-(2,5-チオフェンジイル)ビス(1-ヘキサデシルピリジニウム)
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: C46H76[N+]2S
Molecular formula furigana: C46-H76-N2-S
Molecular weight: 689.190
InChI: InChI=1S/C46H76N2S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37-47-39-33-43(34-40-47)45-31-32-46(49-45)44-35-41-48(42-36-44)38-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-36,39-42H,3-30,37-38H2,1-2H3/q+2
InChI key: WKQXGSJLTPRVEX-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCC[n+]1ccc(cc1)c1ccc(s1)c1cc[n+](CCCCCCCCCCCCCCCC)cc1
Systematic name  (3):
  • 4,4′-(2,5-チオフェンジイル)ビス(1-ヘキサデシルピリジニウム)
  • 1-ヘキサデシル-4-[5-(1-ヘキサデシルピリジン-1-イウム-4-イル)チオフェン-2-イル]ピリジン-1-イウム
  • 1-hexadecyl-4-[5-(1-hexadecylpyridin-1-ium-4-yl)thiophen-2-yl]pyridin-1-ium
Other name (1):
  • 4,4′-(2,5-Thiophenediyl)bis(1-hexadecylpyridinium)
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