2-(2-(4-fluorophenyl)-4-oxothiazolidin-3-yl)acetonitrile | 1158972-16-7

• 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: 2-(2-(4-fluorophenyl)-4-oxothiazolidin-3-yl)acetonitrile
• 英文别名: 2-[2-(4-Fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]acetonitrile
• CAS: 1158972-16-7
• 化学式: C₁₁H₉FN₂OS
• 分子量: 236.27
• InChiKey: KIJWUTIGCVRTSO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  69.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-(2-(4-fluorophenyl)-4-oxothiazolidin-3-yl)acetonitrile 在 一水合肼 、 三乙胺 作用下， 以 乙醇 为溶剂， 反应 12.0h， 以74%的产率得到2-(2-(4-fluorophenyl)-4-oxothiazolidin-3-yl)ethaneiminohydrazide
  参考文献：
  名称：

  Synthesis and antioxidant activity of some thiazolidin-4-one derivatives

  摘要：

  4-Fluorobenzaldehyde was used for the preparation of 2-(4-fluorophenyl) thiazolidin-4-one derivatives which were allowed to react with chloroacetonitrile and acrylonitrile to produce 3-(2-(4-fluorophenyl)-4-oxothiazolidine3-yl) acetonitrile and 3-(2-(4-fluorophenyl)-4-oxothiazoledine-3-yl) propanenitrile. Biological evaluation of some of the compounds showed that many had promising antioxidant activity.

  DOI：

  10.1007/s00706-008-0085-3
• 作为产物：
  描述：

  2-(4-fluorophenyl)-thiazolidin-4-one 、 氯乙腈 以 丙酮 为溶剂， 以85%的产率得到2-(2-(4-fluorophenyl)-4-oxothiazolidin-3-yl)acetonitrile
  参考文献：
  名称：

  Synthesis and antioxidant activity of some thiazolidin-4-one derivatives

  摘要：

  4-Fluorobenzaldehyde was used for the preparation of 2-(4-fluorophenyl) thiazolidin-4-one derivatives which were allowed to react with chloroacetonitrile and acrylonitrile to produce 3-(2-(4-fluorophenyl)-4-oxothiazolidine3-yl) acetonitrile and 3-(2-(4-fluorophenyl)-4-oxothiazoledine-3-yl) propanenitrile. Biological evaluation of some of the compounds showed that many had promising antioxidant activity.

  DOI：

  10.1007/s00706-008-0085-3

文献信息

• Synthesis and antioxidant activity of some thiazolidin-4-one derivatives
  作者：Ahmed O. H. El Nezhawy、Mostafa M. Ramla、Nagy M. Khalifa、Mohamed M. Abdulla

  DOI：10.1007/s00706-008-0085-3

  日期：2009.5

  4-Fluorobenzaldehyde was used for the preparation of 2-(4-fluorophenyl) thiazolidin-4-one derivatives which were allowed to react with chloroacetonitrile and acrylonitrile to produce 3-(2-(4-fluorophenyl)-4-oxothiazolidine3-yl) acetonitrile and 3-(2-(4-fluorophenyl)-4-oxothiazoledine-3-yl) propanenitrile. Biological evaluation of some of the compounds showed that many had promising antioxidant activity.