Chem
J-GLOBAL ID：200907017898067971   Nikkaji number：J734.334E

4,4′,5,5′-Tetrakis(phenylethynyl)-2,2′-bithiophene

4,4′,5,5′-テトラキス(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： C40H22S2
Molecular formula furigana： C40-H22-S2
Molecular weight： 566.740
InChI： InChI=1S/C40H22S2/c1-5-13-31(14-6-1)21-25-35-29-39(41-37(35)27-23-33-17-9-3-10-18-33)40-30-36(26-22-32-15-7-2-8-16-32)38(42-40)28-24-34-19-11-4-12-20-34/h1-20,29-30H
InChI key： IJYQXBUGBYAZQF-UHFFFAOYSA-N
SMILES： c1c(sc(C#Cc2ccccc2)c1C#Cc1ccccc1)c1cc(C#Cc2ccccc2)c(s1)C#Cc1ccccc1
Systematic name  (3)：
  • 4,4′,5,5′-テトラキス(フェニルエチニル)-2,2′-ビチオフェン
  • 4,4',5,5'-テトラキス(2-フェニルエチニル)-2,2'-ビチオフェン
  • 4,4',5,5'-tetrakis(2-phenylethynyl)-2,2'-bithiophene
Other name (1)：
  • 4,4′,5,5′-Tetrakis(phenylethynyl)-2,2′-bithiophene
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