Chem
J-GLOBAL ID：200907014042403920   Nikkaji number：J1.348.175J

5-Chloro-4,3′,3′′,3′′′,3′′′′-pentaoctyl-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-quinquethiophene

5-クロロ-4,3′,3′′,3′′′,3′′′′-ペンタオクチル-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-キンクエチオフェン
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： C60H91ClS5
Molecular formula furigana： C60-H91-CL-S5
Molecular weight： 1008.140
InChI： InChI=1S/C60H91ClS5/c1-6-11-16-21-26-31-36-47-41-42-62-56(47)52-43-48(37-32-27-22-17-12-7-2)57(63-52)53-44-49(38-33-28-23-18-13-8-3)58(64-53)54-45-50(39-34-29-24-19-14-9-4)59(65-54)55-46-51(60(61)66-55)40-35-30-25-20-15-10-5/h41-46H,6-40H2,1-5H3
InChI key： BVDLXGAJZWJELM-UHFFFAOYSA-N
SMILES： CCCCCCCCc1cc(sc1Cl)c1sc(cc1CCCCCCCC)c1sc(cc1CCCCCCCC)c1sc(cc1CCCCCCCC)c1sccc1CCCCCCCC
Systematic name  (4)：
  • 5′′′′-クロロ-3,4′,4′′,4′′′,4′′′′-ペンタオクチル-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-キンクエチオフェン
  • 5-クロロ-4,3′,3′′,3′′′,3′′′′-ペンタオクチル-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-キンクエチオフェン
  • 5'-(5-クロロ-4-オクチルチオフェン-2-イル)-5-{3',4-ジオクチル-[2,2'-ビチオフェン]-5-イル}-3,4'-ジオクチル-2,2'-ビチオフェン
  • 5'-(5-chloro-4-octylthiophen-2-yl)-5-{3',4-dioctyl-[2,2'-bithiophen]-5-yl}-3,4'-dioctyl-2,2'-bithiophene
Other name (2)：
  • 5′′′′-Chloro-3,4′,4′′,4′′′,4′′′′-pentaoctyl-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-quinquethiophene
  • 5-Chloro-4,3′,3′′,3′′′,3′′′′-pentaoctyl-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-quinquethiophene
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Thesaurus Map

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