dimethyl 2-(1-adamantylamine)-3-cyano-3-phenylsulfonyl-2-propenephosphonate | 1312300-00-7

• 英文名称: dimethyl 2-(1-adamantylamine)-3-cyano-3-phenylsulfonyl-2-propenephosphonate
• CAS: 1312300-00-7
• 化学式: C₂₂H₂₉N₂O₅PS
• 分子量: 464.522
• InChiKey: QPMSVXJIQONATE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.24
• 重原子数：
  31.0
• 可旋转键数：
  8.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  105.49
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  金刚烷胺 在 potassium carbonate 作用下， 以 乙醚 、 乙腈 为溶剂， 生成 dimethyl 2-(1-adamantylamine)-3-cyano-3-phenylsulfonyl-2-propenephosphonate
  参考文献：
  名称：

  Reactions of aldoketeniminophosphonates with CH-acids

  摘要：

  Aiming to obtain new polyfunctional organophosphorus compounds, we studied the reactions of aldoketeniminophosphonates with different CH-acids. The reactions were shown to proceed efficiently in anhydrous acetonitrile medium in the presence of the catalytic amounts of potassium carbonate to form the products of the addition of CH-acids to a multiple carbon-carbon bond followed by the prototropic isomerization to the corresponding gamma-substituted beta-functional alkylaminoethenephosphonates. The reaction of aldoketeniminophosphonates with CH-acids is found to depend significantly on the strength and nature of the acid. The formation of the carbon-carbon bond is possible mainly in the case of the CH-acids whose pK (a) values lie within 10-14.

  DOI：

  10.1134/s1070363211040025