Chem
J-GLOBAL ID：200907067872711551   Nikkaji number：J2.050.147B

5-(3,3′′′-Dihexyl-2,2′:5′,2′′:5′′,2′′′-quaterthiophene-5-yl)isophthalaldehyde

5-(3,3′′′-ジヘキシル-2,2′:5′,2′′:5′′,2′′′-クアテルチオフェン-5-イル)イソフタルアルデヒド
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： C36H38O2S4
Molecular formula furigana： C36-H38-O2-S4
Molecular weight： 630.940
InChI： InChI=1S/C36H38O2S4/c1-3-5-7-9-11-27-17-18-39-35(27)32-15-13-30(40-32)31-14-16-33(41-31)36-28(12-10-8-6-4-2)22-34(42-36)29-20-25(23-37)19-26(21-29)24-38/h13-24H,3-12H2,1-2H3
InChI key： OUULJEASHFXHSZ-UHFFFAOYSA-N
SMILES： CCCCCCc1ccsc1c1ccc(s1)c1ccc(s1)c1sc(cc1CCCCCC)c1cc(C=O)cc(C=O)c1
Systematic name  (3)：
  • 5-(3,3′′′-ジヘキシル-2,2′:5′,2′′:5′′,2′′′-クアテルチオフェン-5-イル)イソフタルアルデヒド
  • 5-(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]-5-イル)ベンゼン-1,3-ジカルバルデヒド
  • 5-(3-hexyl-5'-{3'-hexyl-[2,2'-bithiophen]-5-yl}-[2,2'-bithiophen]-5-yl)benzene-1,3-dicarbaldehyde
Other name (1)：
  • 5-(3,3′′′-Dihexyl-2,2′:5′,2′′:5′′,2′′′-quaterthiophene-5-yl)isophthalaldehyde
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