Chem
J-GLOBAL ID：201207004765642206   Nikkaji number：J3.095.758J

3,3′-[Bis(2-ethylhexyl)silanediyl]-5-(5-hexyl-4,6-dioxo-5H-thieno[3,4-c]pyrrole-1-yl)-2,2′-bithiophene

3,3′-[ビス(2-エチルヘキシル)シランジイル]-5-(5-ヘキシル-4,6-ジオキソ-5H-チエノ[3,4-c]ピロール-1-イル)-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： C36H51NO2S3Si
Molecular formula furigana： C36-H51-N-O2-S3-SI
Molecular weight： 654.070
InChI： InChI=1S/C36H51NO2S3Si/c1-6-11-14-15-19-37-35(38)27-22-41-32(31(27)36(37)39)28-21-30-34(42-28)33-29(18-20-40-33)43(30,23-25(9-4)16-12-7-2)24-26(10-5)17-13-8-3/h18,20-22,25-26H,6-17,19,23-24H2,1-5H3
InChI key： SGUIUYXKXUSWON-UHFFFAOYSA-N
SMILES： CCCCCCN1C(=O)c2csc(c3cc4c(s3)c3sccc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)c2C1=O
Systematic name  (3)：
  • 3,3′-[ビス(2-エチルヘキシル)シランジイル]-5-(5-ヘキシル-4,6-ジオキソ-5H-チエノ[3,4-c]ピロール-1-イル)-2,2′-ビチオフェン
  • 1-[7,7-ビス(2-エチルヘキシル)-3,11-ジチア-7-シラトリシクロ[6.3.0.02,6]ウンデカ-1(8),2(6),4,9-テトラエン-4-イル]-5-ヘキシル-4H,5H,6H-チエノ[3,4-c]ピロール-4,6-ジオン
  • 1-[7,7-bis(2-ethylhexyl)-3,11-dithia-7-silatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-5-hexyl-4H,5H,6H-thieno[3,4-c]pyrrole-4,6-dione
Other name (1)：
  • 3,3′-[Bis(2-ethylhexyl)silanediyl]-5-(5-hexyl-4,6-dioxo-5H-thieno[3,4-c]pyrrole-1-yl)-2,2′-bithiophene
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