trimethylvinylammonium (4-chloro-2-methylphenoxy)acetate | 1449583-34-9

• 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: trimethylvinylammonium (4-chloro-2-methylphenoxy)acetate
• CAS: 1449583-34-9
• 化学式: C₅H₁₂N*C₉H₈ClO₃
• 分子量: 285.771
• InChiKey: ITGDYLOJJGBBMF-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  1.61
• 重原子数：
  19.0
• 可旋转键数：
  4.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  49.36
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  2-chloroethyltrimethylammonium (4-chloro-2-methylphenoxy)acetate 在 potassium hydroxide 作用下， 以 水 为溶剂， 反应 24.0h， 以96%的产率得到trimethylvinylammonium (4-chloro-2-methylphenoxy)acetate
  参考文献：
  名称：

  Herbicidal ionic liquid with dual-function

  摘要：

  Herbicidal ionic liquid with dual functions has been synthesized and characterized (properties, chemical stability and biological activity). 2-Chloroethyltrimethylammonium (4-chloro-2-methylphenoxy)acetate prepared in an alkaline environment undergoes the reaction of dehydrochlorination by the E2 mechanism. This may be described as a specific instance of providing third generation ILs with high potential of application, which preserve both pesticidal properties: the herbicidal activity due to their anions and plant growth inhibition effect due to their cations. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2013.07.053