| 1426080-82-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• CAS: 1426080-82-1
• 化学式: C₁₇H₁₅ClNO₄PS
• 分子量: 395.803
• InChiKey: NVWYKHFWNXFTRB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.99
• 重原子数：
  25.0
• 可旋转键数：
  6.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  72.56
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  在 氢溴酸 、 溶剂黄146 作用下， 反应 24.0h， 生成
  参考文献：
  名称：

  Synthesis and some properties of 4-phosphorylated derivatives of 5-mercapto-1,3-oxazoles

  摘要：

  Various approaches to the synthesis of new derivatives of diethyl 5-mercapto-2-R-1,3-oxazole-4-ylphosphonates were considered. The behavior of these compounds in the presence of mineral acids and alkalis resulting in the synthesis of previously unknown 5-mercapto-2-R-1,3-oxazole-4-ylphosphonic acids was studied.

  DOI：

  10.1134/s1070363213010088
• 作为产物：
  描述：

  diethyl 1-benzoylamino-2,2-bis(p-chlorophenylthio)ethenylphosphonate 在 silver carbonate 、 sodium hydroxide 作用下， 以 1,4-二氧六环 、 乙醇 为溶剂， 反应 28.0h， 生成
  参考文献：
  名称：

  Synthesis and some properties of 4-phosphorylated derivatives of 5-mercapto-1,3-oxazoles

  摘要：

  Various approaches to the synthesis of new derivatives of diethyl 5-mercapto-2-R-1,3-oxazole-4-ylphosphonates were considered. The behavior of these compounds in the presence of mineral acids and alkalis resulting in the synthesis of previously unknown 5-mercapto-2-R-1,3-oxazole-4-ylphosphonic acids was studied.

  DOI：

  10.1134/s1070363213010088