[4-((1S,4R,6R,8R)-11,11-Dimethyl-5-oxa-3-thia-tricyclo[6.2.1.0^1,6]undec-4-yl)-3-diphenylphosphanyl-phenyl]-methanol | 849041-75-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [4-((1S,4R,6R,8R)-11,11-Dimethyl-5-oxa-3-thia-tricyclo[6.2.1.0^1,6]undec-4-yl)-3-diphenylphosphanyl-phenyl]-methanol
• 英文别名: [4-[(1S,4R,6R,8R)-11,11-dimethyl-5-oxa-3-thiatricyclo[6.2.1.01,6]undecan-4-yl]-3-diphenylphosphanylphenyl]methanol
• CAS: 849041-75-4
• 化学式: C₃₀H₃₃O₂PS
• 分子量: 488.631
• InChiKey: ALFQSPYOKMDQDL-PDZBSLMJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  34
• 可旋转键数：
  5
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  54.8
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  乙酸酐 、 [4-((1S,4R,6R,8R)-11,11-Dimethyl-5-oxa-3-thia-tricyclo[6.2.1.0^1,6]undec-4-yl)-3-diphenylphosphanyl-phenyl]-methanol 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 5.0h， 以83%的产率得到Acetic acid 4-((1S,4R,6R,8R)-11,11-dimethyl-5-oxa-3-thia-tricyclo[6.2.1.0^1,6]undec-4-yl)-3-diphenylphosphanyl-benzyl ester
  参考文献：
  名称：

  Polymer-supported chiral phosphinooxathiane ligands for palladium-catalyzed asymmetric allylations

  摘要：

  Novel polymer-supported chiral ligands of PS-DES, PS-Et, and TentaGel supporting Pd-phosphinooxathianes were prepared and found to provide high levels of enantioselectivity (up to 99% ee) in palladium-catalyzed asymmetric allylic alkylations and aminations. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2004.11.090
• 作为产物：
  描述：

  二苯基膦 在 四(三苯基膦)钯 对甲苯磺酸 、 三乙胺 作用下， 以 甲苯 、 苯 为溶剂， 反应 26.0h， 生成 [4-((1S,4R,6R,8R)-11,11-Dimethyl-5-oxa-3-thia-tricyclo[6.2.1.0^1,6]undec-4-yl)-3-diphenylphosphanyl-phenyl]-methanol
  参考文献：
  名称：

  Polymer-supported chiral phosphinooxathiane ligands for palladium-catalyzed asymmetric allylations

  摘要：

  Novel polymer-supported chiral ligands of PS-DES, PS-Et, and TentaGel supporting Pd-phosphinooxathianes were prepared and found to provide high levels of enantioselectivity (up to 99% ee) in palladium-catalyzed asymmetric allylic alkylations and aminations. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2004.11.090

文献信息

• Polymer-supported chiral phosphinooxathiane ligands for palladium-catalyzed asymmetric allylations
  作者：Hiroto Nakano、Kouichi Takahashi、Yuri Suzuki、Reiko Fujita

  DOI：10.1016/j.tetasy.2004.11.090

  日期：2005.2

  Novel polymer-supported chiral ligands of PS-DES, PS-Et, and TentaGel supporting Pd-phosphinooxathianes were prepared and found to provide high levels of enantioselectivity (up to 99% ee) in palladium-catalyzed asymmetric allylic alkylations and aminations. (C) 2005 Elsevier Ltd. All rights reserved.