Chem
J-GLOBAL ID：201407098103225604   Nikkaji number：J3.306.001G

5,5′-Bis(4-heptylphenylethynyl)-3,3′-bis(4-pentylphenylethynyl)-2,2′-bithiophene

5,5′-ビス(4-ヘプチルフェニルエチニル)-3,3′-ビス(4-ペンチルフェニルエチニル)-2,2′-ビチオフェン
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： C64H70S2
Molecular formula furigana： C64-H70-S2
Molecular weight： 903.380
InChI： InChI=1S/C64H70S2/c1-5-9-13-15-19-23-53-29-37-57(38-30-53)43-47-61-49-59(45-41-55-33-25-51(26-34-55)21-17-11-7-3)63(65-61)64-60(46-42-56-35-27-52(28-36-56)22-18-12-8-4)50-62(66-64)48-44-58-39-31-54(32-40-58)24-20-16-14-10-6-2/h25-40,49-50H,5-24H2,1-4H3
InChI key： GFKHYONZEQUOMW-UHFFFAOYSA-N
SMILES： CCCCCCCc1ccc(cc1)C#Cc1cc(C#Cc2ccc(CCCCC)cc2)c(s1)c1sc(cc1C#Cc1ccc(CCCCC)cc1)C#Cc1ccc(CCCCCCC)cc1
Systematic name  (3)：
  • 5,5′-ビス(4-ヘプチルフェニルエチニル)-3,3′-ビス(4-ペンチルフェニルエチニル)-2,2′-ビチオフェン
  • 5,5'-ビス[2-(4-ヘプチルフェニル)エチニル]-3,3'-ビス[2-(4-ペンチルフェニル)エチニル]-2,2'-ビチオフェン
  • 5,5'-bis[2-(4-heptylphenyl)ethynyl]-3,3'-bis[2-(4-pentylphenyl)ethynyl]-2,2'-bithiophene
Other name (1)：
  • 5,5′-Bis(4-heptylphenylethynyl)-3,3′-bis(4-pentylphenylethynyl)-2,2′-bithiophene
Thsaurus map：
Thesaurus Map

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