N-hydroxy-2-methylfuran-3-carboxamide | 1016760-01-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃
• 英文名称: N-hydroxy-2-methylfuran-3-carboxamide
• CAS: 1016760-01-2
• 化学式: C₆H₇NO₃
• mdl: MFCD09932987
• 分子量: 141.126
• InChiKey: OXEUZFULBOUJLT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.2
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.166
• 拓扑面积：
  62.5
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-甲基-3-糠酸甲酯 在 羟胺 、 sodium methylate 作用下， 以 甲醇 、 水 为溶剂， 以52%的产率得到N-hydroxy-2-methylfuran-3-carboxamide
  参考文献：
  名称：

  Efficient Continuous Flow Synthesis of Hydroxamic Acids and Suberoylanilide Hydroxamic Acid Preparation

  摘要：

  A continuous flow tubing reactor can be used to readily transform methyl or ethyl carboxylic esters into the corresponding hydroxamic acids. Flow rate, reactor volume, and temperature were optimized for the preparation of a small collection of hydroxamic acids. Synthetic advantages were identified as an increased reaction rate and higher product purity. This method was also successfully applied to the multistep preparation of suberoylanilide hydroxamic acid, a potent HDAC inhibitor used in anticancer therapy.

  DOI：

  10.1021/jo900144h