Chem
J-GLOBAL ID：201207004846247379   Nikkaji number：J3.048.597A

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

1,4-ビス[2,5-ジプロピル-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-ジプロピルベンゼン
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： C96H114
Molecular formula furigana： C96-H114
Molecular weight： 1267.968
InChI： InChI=1S/C96H114/c1-13-25-27-29-31-33-41-73-43-47-75(48-44-73)51-53-87-63-79(23-11)89(65-77(87)21-9)55-57-91-67-83(37-17-5)93(69-81(91)35-15-3)59-61-95-71-86(40-20-8)96(72-85(95)39-19-7)62-60-94-70-82(36-16-4)92(68-84(94)38-18-6)58-56-90-66-78(22-10)88(64-80(90)24-12)54-52-76-49-45-74(46-50-76)42-34-32-30-28-26-14-2/h43-50,63-72H,13-42H2,1-12H3
InChI key： XQLPILHPTLZPQJ-UHFFFAOYSA-N
SMILES： CCCCCCCCc1ccc(cc1)C#Cc1cc(CC)c(cc1CC)C#Cc1cc(CCC)c(cc1CCC)C#Cc1cc(CCC)c(cc1CCC)C#Cc1cc(CCC)c(cc1CCC)C#Cc1cc(CC)c(cc1CC)C#Cc1ccc(CCCCCCCC)cc1
Systematic name  (3)：
  • 1,4-ビス[2,5-ジプロピル-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-ジプロピルベンゼン
  • 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)-2,5-ジプロピルフェニル]エチニル}-2,5-ジプロピルフェニル)エチニル]-2,5-ジプロピルフェニル}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)-2,5-dipropylphenyl]ethynyl}-2,5-dipropylphenyl)ethynyl]-2,5-dipropylphenyl}ethynyl)-2,5-diethyl-4-[2-(4-octylphenyl)ethynyl]benzene
Other name (1)：
  • 1,4-Bis[2,5-dipropyl-4-[2,5-diethyl-4-(4-octylphenylethynyl)phenylethynyl]phenylethynyl]-2,5-dipropylbenzene
Thsaurus map：
Thesaurus Map

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