Chem
J-GLOBAL ID:200907049407729187   Nikkaji number:J2.145.692F

2,5-Bis[2-[9-[6-(trimethylaminio)hexyl]-9H-carbazole-3-yl]vinyl]-1,4-[2,5-bis[2-[9-[6-(trimethylaminio)hexyl]-9H-carbazole-3-yl]vinyl]-1,4-phenylenebisethylene]benzene

2,5-ビス[2-[9-[6-(トリメチルアミニオ)ヘキシル]-9H-カルバゾール-3-イル]ビニル]-1,4-[2,5-ビス[2-[9-[6-(トリメチルアミニオ)ヘキシル]-9H-カルバゾール-3-イル]ビニル]-1,4-フェニレンビスエチレン]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: C108H132N4[N+]4
Molecular formula furigana: C108-H132-N8
Molecular weight: 1542.298
InChI: InChI=1S/C108H132N8/c1-113(2,3)69-33-17-13-29-65-109-101-41-25-21-37-93(101)97-73-81(49-61-105(97)109)45-53-85-77-90-59-60-92-80-87(55-47-83-51-63-107-99(75-83)95-39-23-27-43-103(95)111(107)67-31-15-19-35-71-115(7,8)9)91(79-88(92)56-48-84-52-64-108-100(76-84)96-40-24-28-44-104(96)112(108)68-32-16-20-36-72-116(10,11)12)58-57-89(85)78-86(90)54-46-82-50-62-106-98(74-82)94-38-22-26-42-102(94)110(106)66-30-14-18-34-70-114(4,5)6/h21-28,37-56,61-64,73-80H,13-20,29-36,57-60,65-72H2,1-12H3/q+4
InChI key: ZUAFMSXIEJLVRR-UHFFFAOYSA-N
SMILES: C[N+](C)(C)CCCCCCn1c2ccccc2c2cc(C=Cc3cc4CCc5cc(C=Cc6ccc7n(CCCCCC[N+](C)(C)C)c8ccccc8c7c6)c(CCc3cc4C=Cc3ccc4n(CCCCCC[N+](C)(C)C)c6ccccc6c4c3)cc5C=Cc3ccc4n(CCCCCC[N+](C)(C)C)c5ccccc5c4c3)ccc12
Systematic name  (4):
  • 2,5-ビス[2-[9-[6-(トリメチルアミニオ)ヘキシル]-9H-カルバゾール-3-イル]ビニル]-1,4-[2,5-ビス[2-[9-[6-(トリメチルアミニオ)ヘキシル]-9H-カルバゾール-3-イル]ビニル]-1,4-フェニレンビスエチレン]ベンゼン
  • 3,3′,3′′,3′′′-[トリシクロ[8.2.2.24,7]ヘキサデカン-1(12),4(16),5,7(15),10,13-ヘキサエン-6,11,13,16-テトライルテトラ(1,2-エテンジイル)]テトラ[9-[6-(トリメチルアミニオ)ヘキシル]-9H-カルバゾール]
  • トリメチル[6-(3-{2-[12,14,15-トリス(2-{9-[6-(トリメチルアザニウミル)ヘキシル]-9H-カルバゾール-3-イル}エテニル)トリシクロ[8.2.2.24,7]ヘキサデカ-1(12),4(16),5,7(15),10,13-ヘキサエン-5-イル]エテニル}-9H-カルバゾール-9-イル)ヘキシル]アザニウム
  • trimethyl[6-(3-{2-[12,14,15-tris(2-{9-[6-(trimethylazaniumyl)hexyl]-9H-carbazol-3-yl}ethenyl)tricyclo[8.2.2.24,7]hexadeca-1(12),4(16),5,7(15),10,13-hexaen-5-yl]ethenyl}-9H-carbazol-9-yl)hexyl]azanium
Other name (2):
  • 2,5-Bis[2-[9-[6-(trimethylaminio)hexyl]-9H-carbazole-3-yl]vinyl]-1,4-[2,5-bis[2-[9-[6-(trimethylaminio)hexyl]-9H-carbazole-3-yl]vinyl]-1,4-phenylenebisethylene]benzene
  • 3,3′,3′′,3′′′-[Tricyclo[8.2.2.24,7]hexadecane-1(12),4(16),5,7(15),10,13-hexaene-6,11,13,16-tetrayltetra(1,2-ethenediyl)]tetra[9-[6-(trimethylaminio)hexyl]-9H-carbazole]
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