Chem
J-GLOBAL ID:200907026260186492
Nikkaji number:J1.348.171G
5′′-Chloro-3,4′,4′′-trioctyl-2,2′:5′,2′′-terthiophene
5′′-クロロ-3,4′,4′′-トリオクチル-2,2′:5′,2′′-テルチオフェン
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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:
C36 H55 ClS3
Molecular formula furigana:
C36-H55-CL-S3
Molecular weight:
619.470
InChI:
InChI=1S/C36H55ClS3/c1-4-7-10-13-16-19-22-29-25-26-38-34(29)32-27-30(23-20-17-14-11-8-5-2)35(39-32)33-28-31(36(37)40-33)24-21-18-15-12-9-6-3/h25-28H,4-24H2,1-3H3
InChI key:
LVMBQAQNYSMEHH-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1cc(sc1Cl)c1sc(cc1CCCCCCCC)c1sccc1CCCCCCCC
Systematic name (3):
5′′-クロロ-3,4′,4′′-トリオクチル-2,2′:5′,2′′-テルチオフェン
5'-(5-クロロ-4-オクチルチオフェン-2-イル)-3,4'-ジオクチル-2,2'-ビチオフェン
5'-(5-chloro-4-octylthiophen-2-yl)-3,4'-dioctyl-2,2'-bithiophene
Other name (1):
5′′-Chloro-3,4′,4′′-trioctyl-2,2′:5′,2′′-terthiophene
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