Chem
J-GLOBAL ID：201207039001368876   Nikkaji number：J3.048.601C

1,4-Bis[2,5-dihexyl-4-[4-(4-ethylphenylethynyl)phenylethynyl]phenylethynyl]-2,5-dihexylbenzene

1,4-ビス[2,5-ジヘキシル-4-[4-(4-エ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-ジヘキシルベンゼン
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/c1-9-17-23-29-35-83-71-91(85(37-31-25-19-11-3)69-89(83)63-61-81-57-53-79(54-58-81)51-49-77-45-41-75(15-7)42-46-77)65-67-93-73-88(40-34-28-22-14-6)94(74-87(93)39-33-27-21-13-5)68-66-92-72-84(36-30-24-18-10-2)90(70-86(92)38-32-26-20-12-4)64-62-82-59-55-80(56-60-82)52-50-78-47-43-76(16-8)44-48-78/h41-48,53-60,69-74H,9-40H2,1-8H3
InChI key： AQZKVFCJJTWCGC-UHFFFAOYSA-N
SMILES： CCCCCCc1cc(C#Cc2cc(CCCCCC)c(cc2CCCCCC)C#Cc2cc(CCCCCC)c(cc2CCCCCC)C#Cc2ccc(cc2)C#Cc2ccc(CC)cc2)c(CCCCCC)cc1C#Cc1ccc(cc1)C#Cc1ccc(CC)cc1
Systematic name  (3)：
  • 1,4-ビス[2,5-ジヘキシル-4-[4-(4-エ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-ジヘキシルベンゼン
  • 1-(2-{4-[2-(4-エチルフェニル)エチニル]フェニル}エチニル)-4-[2-(4-{2-[4-(2-{4-[2-(4-エチルフェニル)エチニル]フェニル}エチニル)-2,5-ジヘキシルフェニル]エチニル}-2,5-ジヘキシルフェニル)エチニル]-2,5-ジヘキシルベンゼン
  • 1-(2-{4-[2-(4-ethylphenyl)ethynyl]phenyl}ethynyl)-4-[2-(4-{2-[4-(2-{4-[2-(4-ethylphenyl)ethynyl]phenyl}ethynyl)-2,5-dihexylphenyl]ethynyl}-2,5-dihexylphenyl)ethynyl]-2,5-dihexylbenzene
Other name (1)：
  • 1,4-Bis[2,5-dihexyl-4-[4-(4-ethylphenylethynyl)phenylethynyl]phenylethynyl]-2,5-dihexylbenzene
Thsaurus map：
Thesaurus Map

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