Chem
J-GLOBAL ID：201207090748871726   Nikkaji number：J3.048.600E

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

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-ジオクチルベンゼン
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： C94H110
Molecular formula furigana： C94-H110
Molecular weight： 1239.914
InChI： InChI=1S/C94H110/c1-9-17-21-25-29-33-37-75-41-45-77(46-42-75)57-63-89-69-85(15-7)91(71-83(89)13-5)65-59-79-49-53-81(54-50-79)61-67-93-73-88(40-36-32-28-24-20-12-4)94(74-87(93)39-35-31-27-23-19-11-3)68-62-82-55-51-80(52-56-82)60-66-92-72-84(14-6)90(70-86(92)16-8)64-58-78-47-43-76(44-48-78)38-34-30-26-22-18-10-2/h41-56,69-74H,9-40H2,1-8H3
InChI key： DPIVEMBNYHEBLF-UHFFFAOYSA-N
SMILES： CCCCCCCCc1ccc(cc1)C#Cc1cc(CC)c(cc1CC)C#Cc1ccc(cc1)C#Cc1cc(CCCCCCCC)c(cc1CCCCCCCC)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-ジオクチルベンゼン
  • 1-(2-{4-[2-(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}-2,5-ジオクチルフェニル)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-(4-{2-[4-(2-{2,5-diethyl-4-[2-(4-octylphenyl)ethynyl]phenyl}ethynyl)phenyl]ethynyl}-2,5-dioctylphenyl)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-dioctylbenzene
Thsaurus map：
Thesaurus Map

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