Chem
J-GLOBAL ID：201207032310654030   Nikkaji number：J3.048.598J

1,4-Bis[4-[2,5-diethyl-4-(4-octylphenylethynyl)phenylethynyl]phenylethynyl]-2,5-dibutylbenzene

1,4-ビス[4-[2,5-ジエチル-4-(4-オクチルフェニルエチニル)フェニルエチニル]フェニルエチニル]-2,5-ジブチルベンゼン
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： C86H94
Molecular formula furigana： C86-H94
Molecular weight： 1127.698
InChI： InChI=1S/C86H94/c1-9-17-21-23-25-27-29-67-33-37-69(38-34-67)49-55-81-61-77(15-7)83(63-75(81)13-5)57-51-71-41-45-73(46-42-71)53-59-85-65-80(32-20-12-4)86(66-79(85)31-19-11-3)60-54-74-47-43-72(44-48-74)52-58-84-64-76(14-6)82(62-78(84)16-8)56-50-70-39-35-68(36-40-70)30-28-26-24-22-18-10-2/h33-48,61-66H,9-32H2,1-8H3
InChI key： PTDGFNOEVNHATL-UHFFFAOYSA-N
SMILES： CCCCCCCCc1ccc(cc1)C#Cc1cc(CC)c(cc1CC)C#Cc1ccc(cc1)C#Cc1cc(CCCC)c(cc1CCCC)C#Cc1ccc(cc1)C#Cc1cc(CC)c(cc1CC)C#Cc1ccc(CCCCCCCC)cc1
Systematic name  (3)：
  • 1,4-ビス[4-[2,5-ジエチル-4-(4-オクチルフェニルエチニル)フェニルエチニル]フェニルエチニル]-2,5-ジブチルベンゼン
  • 1-(2-{4-[2-(2,5-ジブチル-4-{2-[4-(2-{2,5-ジエチル-4-[2-(4-オクチルフェニル)エチニル]フェニル}エチニル)フェニル]エチニル}フェニル)エチニル]フェニル}エチニル)-2,5-ジエチル-4-[2-(4-オクチルフェニル)エチニル]ベンゼン
  • 1-(2-{4-[2-(2,5-dibutyl-4-{2-[4-(2-{2,5-diethyl-4-[2-(4-octylphenyl)ethynyl]phenyl}ethynyl)phenyl]ethynyl}phenyl)ethynyl]phenyl}ethynyl)-2,5-diethyl-4-[2-(4-octylphenyl)ethynyl]benzene
Other name (1)：
  • 1,4-Bis[4-[2,5-diethyl-4-(4-octylphenylethynyl)phenylethynyl]phenylethynyl]-2,5-dibutylbenzene
Thsaurus map：
Thesaurus Map

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