1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]propan-2-one | 1111848-89-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]propan-2-one
• CAS: 1111848-89-5
• 化学式: C₁₂H₁₂N₂O₂
• 分子量: 216.239
• InChiKey: ZFCKYUWMNJHERO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  56
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  乙酰乙酸异丁酯 、 N-羟基-2-甲基苯甲脒 生成 1-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]propan-2-one
  参考文献：
  名称：

  Synthesis of Novel 5-(Pyrimidin-5-yl)-1,2,4-oxadiazole Derivatives via a Three-Component Cycloaddition and Subsequent Oxidative Dehydrogenation

  摘要：

  A new and efficient strategy has been developed for the synthesis of novel 5-(pyrimidin-5-yl)-1,2,4-oxadiazoles with a wide diversity in substituents via Biginelli cycloaddition and subsequent oxidative dehydrogenation.

  DOI：

  10.3987/com-10-12026

文献信息

• Synthesis of Novel 5-(Pyrimidin-5-yl)-1,2,4-oxadiazole Derivatives via a Three-Component Cycloaddition and Subsequent Oxidative Dehydrogenation
  作者：Ai-Dong Zhang、Hai-Yang Tu、Ming Liu、Tong-Hui Huang

  DOI：10.3987/com-10-12026

  日期：——

  A new and efficient strategy has been developed for the synthesis of novel 5-(pyrimidin-5-yl)-1,2,4-oxadiazoles with a wide diversity in substituents via Biginelli cycloaddition and subsequent oxidative dehydrogenation.