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Atomfair (3AS,6R,7AR)-8,8-Dimethyl-1-((trifluoromethyl)thio)hexahydro-3H-3A,6-methanobenzo[C]isothiazole 2,2-dioxide C11H16F3NO2S2

Description The (3AS,6R,7AR)-8,8-Dimethyl-1-((trifluoromethyl)thio)hexahydro-3H-3A,6-methanobenzo[C]isothiazole 2,2-dioxide (CAS No. 2094737-51-4) is a high-purity, synthetic organic compound with the molecular formula C11H16F3NO2S2. This bicyclic sulfonamide derivative features a trifluoromethylthio group, enhancing its reactivity and potential applications in advanced chemical synthesis. Its rigid tricyclic structure and stereochemical complexity make it a valuable intermediate for pharmaceutical research and agrochemical development. The compound is supplied as a white to off-white crystalline solid with ??95% purity (HPLC), ensuring consistency for sensitive reactions. Store under inert conditions at 2-8??C to maintain stability.

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Description

Description

The (3AS,6R,7AR)-8,8-Dimethyl-1-((trifluoromethyl)thio)hexahydro-3H-3A,6-methanobenzo[C]isothiazole 2,2-dioxide (CAS No. 2094737-51-4) is a high-purity, synthetic organic compound with the molecular formula C11H16F3NO2S2. This bicyclic sulfonamide derivative features a trifluoromethylthio group, enhancing its reactivity and potential applications in advanced chemical synthesis. Its rigid tricyclic structure and stereochemical complexity make it a valuable intermediate for pharmaceutical research and agrochemical development. The compound is supplied as a white to off-white crystalline solid with ??95% purity (HPLC), ensuring consistency for sensitive reactions. Store under inert conditions at 2-8??C to maintain stability.

  • CAS No: 2094737-51-4
  • Molecular Formula: C11H16F3NO2S2
  • Molecular Weight: 315.4
  • Exact Mass: 315.05745559
  • Monoisotopic Mass: 315.05745559
  • IUPAC Name: (1S,5R,7R)-10,10-dimethyl-4-(trifluoromethylsulfanyl)-3lambda6-thia-4-azatricyclo[5.2.1.01,5]decane 3,3-dioxide
  • SMILES: CC1([C@@H]2CC[C@]13CS(=O)(=O)N([C@@H]3C2)SC(F)(F)F)C
  • Synonyms: MFCD34663183, F88832, (3AS,6R,7AR)-8,8-DIMETHYL-1-((TRIFLUOROMETHYL)THIO)HEXAHYDRO-3H-3A,6-METHANOBENZO[C]ISOTHIAZOLE 2,2-DIOXIDE

Application

This compound serves as a versatile building block in medicinal chemistry, particularly for the synthesis of bioactive molecules targeting CNS disorders due to its rigid, lipophilic framework. Its trifluoromethylthio group enables facile derivatization for structure-activity relationship (SAR) studies in drug discovery. Researchers also utilize it as a chiral auxiliary in asymmetric synthesis, leveraging its stereodefined [3.2.1] bicyclic scaffold.

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