Chem
J-GLOBAL ID：200907012989324193   Nikkaji number：J1.085.798H

3,3′′′-Dihexyl-2,2′:5′,2′′:5′′,2′′′-quaterthiophene

2,2′-(2,2′-ビチオフェン-5,5′-ジイル)ビス(3-ヘキシルチオフェン)
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： C28H34S4
Molecular formula furigana： C28-H34-S4
Molecular weight： 498.820
InChI： InChI=1S/C28H34S4/c1-3-5-7-9-11-21-17-19-29-27(21)25-15-13-23(31-25)24-14-16-26(32-24)28-22(18-20-30-28)12-10-8-6-4-2/h13-20H,3-12H2,1-2H3
InChI key： MLDVGCCQHBDHDR-UHFFFAOYSA-N
SMILES： CCCCCCc1ccsc1c1ccc(s1)c1ccc(s1)c1sccc1CCCCCC
Systematic name  (4)：
  • 3,3′′′-ジヘキシル-2,2′:5′,2′′:5′′,2′′′-クアテルチオフェン
  • 2,2′-(2,2′-ビチオフェン-5,5′-ジイル)ビス(3-ヘキシルチオフェン)
  • 3-ヘキシル-5'-{3'-ヘキシル-[2,2'-ビチオフェン]-5-イル}-2,2'-ビチオフェン
  • 3-hexyl-5'-{3'-hexyl-[2,2'-bithiophen]-5-yl}-2,2'-bithiophene
Other name (2)：
  • 3,3′′′-Dihexyl-2,2′:5′,2′′:5′′,2′′′-quaterthiophene
  • 2,2′-(2,2′-Bithiophene-5,5′-diyl)bis(3-hexylthiophene)
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