Chem
J-GLOBAL ID:200907043572051120   Nikkaji number:J2.211.345C

3,3′-(Hexafluorocyclopentene-1,2-diyl)bis(2-methyl-6-acetylbenzo[b]thiophene)

3,3′-(ヘキサフルオロシクロペンテン-1,2-ジイル)ビス(2-メチル-6-アセチルベンゾ[b]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: C27H18F6O2S2
Molecular formula furigana: C27-H18-F6-O2-S2
Molecular weight: 552.550
InChI: InChI=1S/C27H18F6O2S2/c1-11(34)15-5-7-17-19(9-15)36-13(3)21(17)23-24(26(30,31)27(32,33)25(23,28)29)22-14(4)37-20-10-16(12(2)35)6-8-18(20)22/h5-10H,1-4H3
InChI key: KPGVVTWTJACUEV-UHFFFAOYSA-N
SMILES: CC(=O)c1ccc2c(C3=C(c4c(C)sc5cc(ccc45)C(=O)C)C(F)(F)C(F)(F)C3(F)F)c(C)sc2c1
Systematic name  (5):
  • 1,2-ビス(2-メチル-6-アセチルベンゾ[b]チオフェン-3-イル)-3,3,4,4,5,5-ヘキサフルオロ-1-シクロペンテン
  • 3,3′-(3,3,4,4,5,5-ヘキサフルオロ-1-シクロペンテン-1,2-ジイル)ビス(2-メチル-6-アセチルベンゾ[b]チオフェン)
  • 3,3′-(ヘキサフルオロシクロペンテン-1,2-ジイル)ビス(2-メチル-6-アセチルベンゾ[b]チオフェン)
  • 1-{3-[2-(6-アセチル-2-メチル-1-ベンゾチオフェン-3-イル)-3,3,4,4,5,5-ヘキサフルオロシクロペンタ-1-エン-1-イル]-2-メチル-1-ベンゾチオフェン-6-イル}エタン-1-オン
  • 1-{3-[2-(6-acetyl-2-methyl-1-benzothiophen-3-yl)-3,3,4,4,5,5-hexafluorocyclopent-1-en-1-yl]-2-methyl-1-benzothiophen-6-yl}ethan-1-one
Other name (3):
  • 1,2-Bis(2-methyl-6-acetylbenzo[b]thiophene-3-yl)-3,3,4,4,5,5-hexafluoro-1-cyclopentene
  • 3,3′-(3,3,4,4,5,5-Hexafluoro-1-cyclopentene-1,2-diyl)bis(2-methyl-6-acetylbenzo[b]thiophene)
  • 3,3′-(Hexafluorocyclopentene-1,2-diyl)bis(2-methyl-6-acetylbenzo[b]thiophene)
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