Chem
J-GLOBAL ID：201407060857719746   Nikkaji number：J3.296.136C

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

3,3′,5,5′-テトラキス(4-エ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： C48H38S2
Molecular formula furigana： C48-H38-S2
Molecular weight： 678.950
InChI： InChI=1S/C48H38S2/c1-5-35-9-17-39(18-10-35)25-29-43-33-45(31-27-41-21-13-37(7-3)14-22-41)49-47(43)48-44(30-26-40-19-11-36(6-2)12-20-40)34-46(50-48)32-28-42-23-15-38(8-4)16-24-42/h9-24,33-34H,5-8H2,1-4H3
InChI key： OVNHHLPJYHEFMT-UHFFFAOYSA-N
SMILES： CCc1ccc(cc1)C#Cc1cc(C#Cc2ccc(CC)cc2)c(s1)c1sc(cc1C#Cc1ccc(CC)cc1)C#Cc1ccc(CC)cc1
Systematic name  (3)：
  • 3,3′,5,5′-テトラキス(4-エチ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-エチルフェニル)エチニル]-2,2'-ビチオフェン
  • 3,3',5,5'-tetrakis[2-(4-ethylphenyl)ethynyl]-2,2'-bithiophene
Other name (1)：
  • 3,3′,5,5′-Tetrakis(4-ethylphenylethynyl)-2,2′-bithiophene
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