ethyl [4-hydroxy-5-oxo-4-(trifluoromethyl)pyrrolidin-2-ylidene]acetate | 1225583-56-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯烷类
• 英文名称: ethyl [4-hydroxy-5-oxo-4-(trifluoromethyl)pyrrolidin-2-ylidene]acetate
• 英文别名: Ethyl 2-[4-hydroxy-5-oxo-4-(trifluoromethyl)pyrrolidin-2-ylidene]acetate；ethyl (2Z)-2-[4-hydroxy-5-oxo-4-(trifluoromethyl)pyrrolidin-2-ylidene]acetate
• CAS: 1225583-56-1
• 化学式: C₉H₁₀F₃NO₄
• mdl: MFCD09702330
• 分子量: 253.178
• InChiKey: GANCNNHKJHYFKX-HYXAFXHYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.555
• 拓扑面积：
  75.6
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  1-ethyl 6-methyl 3-amino-5-hydroxy-5-(trifluoromethyl)-2-hexendicarboxylate 以 甲醇 、 水 为溶剂， 反应 0.17h， 生成 ethyl [4-hydroxy-5-oxo-4-(trifluoromethyl)pyrrolidin-2-ylidene]acetate
  参考文献：
  名称：

  Convenient synthesis of trifluoromethylated 2-pyrrolidone and 2-pyrrolone derivatives

  摘要：

  The reaction of a set of enamines with methyl trifluoropyruvate and its imine was investigated. As a result, a simple procedure for synthesis of trifluoromethylated 2-pyrrolidone and 2-pyrrolone derivatives has been developed. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2009.09.013

文献信息

• Convenient synthesis of trifluoromethylated 2-pyrrolidone and 2-pyrrolone derivatives
  作者：Dmitriy A. Sibgatulin、Alexander N. Kostyuk、Dmitriy M. Volochnyuk、Eduard B. Rusanov、Alexander N. Chernega

  DOI：10.1016/j.jfluchem.2009.09.013

  日期：2010.2

  The reaction of a set of enamines with methyl trifluoropyruvate and its imine was investigated. As a result, a simple procedure for synthesis of trifluoromethylated 2-pyrrolidone and 2-pyrrolone derivatives has been developed. (C) 2009 Elsevier B.V. All rights reserved.