Chem
J-GLOBAL ID：200907090092695734   Nikkaji number：J1.023.649E

5,6-(Hexafluorotrimethylene)-11a,11b-dihydro-11aα,11bβ-dimethylbenzo[2,1-b:3,4-b′]bis[1]benzothiophene

5,6-(ヘキサフルオロトリメチレン)-11a,11b-ジヒドロ-11aα,11bβ-ジメチルベンゾ[2,1-b:3,4-b′]ビス[1]ベンゾチオフェン
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： C23H14F6S2
Molecular formula furigana： C23-H14-F6-S2
Molecular weight： 468.480
InChI： InChI=1S/C23H14F6S2/c1-19-15(11-7-3-5-9-13(11)30-19)17-18(22(26,27)23(28,29)21(17,24)25)16-12-8-4-6-10-14(12)31-20(16,19)2/h3-10H,1-2H3/t19-,20-/m1/s1
InChI key： ZTFKBGNXWVCWLA-WOJBJXKFSA-N
SMILES： C[C@@]12Sc3ccccc3C1=C1C(=C3c4ccccc4S[C@@]23C)C(F)(F)C(F)(F)C1(F)F
Systematic name  (10)：
  • 11aα,11bβ-ジメチル-13,13,14,14,15,15-ヘキサフルオロ-11a,11b-ジヒドロ-5,6-プロパノベンゾ[2,1-b:3,4-b′]ビス[1]ベンゾチオフェン
  • (11aR)-11aα,11bβ-ジメチル-13,13,14,14,15,15-ヘキサフルオロ-5,6-プロパノベンゾ[2,1-b:3,4-b′]ビス[1]ベンゾチオフェン
  • 5,6-(ヘキサフルオロトリメチレン)-11a,11b-ジヒドロ-11aα,11bβ-ジメチルベンゾ[2,1-b:3,4-b′]ビス[1]ベンゾチオフェン
  • (11aR)-11aα,11bβ-ジメチル-11a,11b-ジヒドロ-5,6-(1,1,2,2,3,3-ヘキサフルオロ-1,3-プロパンジイル)ベンゾ[2,1-b:3,4-b′]ビス[1]ベンゾチオフェン
  • (11aR)-11aα,11bβ-ジメチル-13,13,14,14,15,15-ヘキサフルオロ-11a,11b-ジヒドロ-5,6-プロパノベンゾ[2,1-b:3,4-b′]ビス[1]ベンゾチオフェン
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Other name (10)：
  • 11aα,11bβ-Dimethyl-13,13,14,14,15,15-hexafluoro-11a,11b-dihydro-5,6-propanobenzo[2,1-b:3,4-b′]bis[1]benzothiophene
  • (11aR)-11aα,11bβ-Dimethyl-13,13,14,14,15,15-hexafluoro-5,6-propanobenzo[2,1-b:3,4-b′]bis[1]benzothiophene
  • 5,6-(Hexafluorotrimethylene)-11a,11b-dihydro-11aα,11bβ-dimethylbenzo[2,1-b:3,4-b′]bis[1]benzothiophene
  • (11aR)-11aα,11bβ-Dimethyl-11a,11b-dihydro-5,6-(1,1,2,2,3,3-hexafluoro-1,3-propanediyl)benzo[2,1-b:3,4-b′]bis[1]benzothiophene
  • (11aR)-11aα,11bβ-Dimethyl-13,13,14,14,15,15-hexafluoro-11a,11b-dihydro-5,6-propanobenzo[2,1-b:3,4-b′]bis[1]benzothiophene
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