| 1579294-60-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• CAS: 1579294-60-2
• 化学式: C₁₄H₁₅ClF₄N₂O₂S
• 分子量: 386.798
• InChiKey: HPYXPXFQNYLDDZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.42
• 重原子数：
  24.0
• 可旋转键数：
  5.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  41.9
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  三甲基氰硅烷 、 在 cesium fluoride 作用下， 以 二氯甲烷 为溶剂， 反应 27.0h， 以84%的产率得到
  参考文献：
  名称：

  The Synthesis and Strecker Reaction of 2-Chlorotetrafluoroethanesulfinyl Ketimines

  摘要：

  A series of 2-chlorotetrafluoroethanesulfinyl ketimines were prepared from 2-chlorotetrafluoroethanesulfinamide and ketones in high yields, and their Strecker reactions with TMSCN have been investigated. High yields and excellent diastereoselectivities were achieved in the presence of a catalytic amount of CsF under mild conditions. The six-membered chairlike models were proposed to account for the high stereoselective Strecker reaction.

  DOI：

  10.1021/jo500008e
• 作为产物：
  描述：

  2-chloro-1,1,2,2-tetrafluoroethanesulfinamide 、 4-(4-吗啉基)苯乙酮 在 titanium (IV) ethoxide 作用下， 以 环己烷 为溶剂， 反应 48.0h， 以41%的产率得到
  参考文献：
  名称：

  The Synthesis and Strecker Reaction of 2-Chlorotetrafluoroethanesulfinyl Ketimines

  摘要：

  A series of 2-chlorotetrafluoroethanesulfinyl ketimines were prepared from 2-chlorotetrafluoroethanesulfinamide and ketones in high yields, and their Strecker reactions with TMSCN have been investigated. High yields and excellent diastereoselectivities were achieved in the presence of a catalytic amount of CsF under mild conditions. The six-membered chairlike models were proposed to account for the high stereoselective Strecker reaction.

  DOI：

  10.1021/jo500008e