Chem
J-GLOBAL ID：201407006443044033   Nikkaji number：J3.296.133I

3,3′,5,5′-Tetrakis(4-hexylphenylethynyl)-2,2′-bithiophene

3,3′,5,5′-テトラキス(4-ヘキシ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/c1-5-9-13-17-21-51-25-33-55(34-26-51)41-45-59-49-61(47-43-57-37-29-53(30-38-57)23-19-15-11-7-3)65-63(59)64-60(46-42-56-35-27-52(28-36-56)22-18-14-10-6-2)50-62(66-64)48-44-58-39-31-54(32-40-58)24-20-16-12-8-4/h25-40,49-50H,5-24H2,1-4H3
InChI key： FCGUQCPZBNZWPL-UHFFFAOYSA-N
SMILES： CCCCCCc1ccc(cc1)C#Cc1cc(C#Cc2ccc(CCCCCC)cc2)c(s1)c1sc(cc1C#Cc1ccc(CCCCCC)cc1)C#Cc1ccc(CCCCCC)cc1
Systematic name  (3)：
  • 3,3′,5,5′-テトラキス(4-ヘキシルフェニルエチニル)-2,2′-ビチオフェン
  • 3,3',5,5'-テトラキス[2-(4-ヘキシルフェニル)エチニル]-2,2'-ビチオフェン
  • 3,3',5,5'-tetrakis[2-(4-hexylphenyl)ethynyl]-2,2'-bithiophene
Other name (1)：
  • 3,3′,5,5′-Tetrakis(4-hexylphenylethynyl)-2,2′-bithiophene
Thsaurus map：
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