1-octyl-2,3-dimethylimidazolium dimethylphosphate | 1583289-43-3

• 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-octyl-2,3-dimethylimidazolium dimethylphosphate
• CAS: 1583289-43-3
• 化学式: C₂H₆O₄P*C₁₃H₂₅N₂
• 分子量: 334.396
• InChiKey: NMPBCUZOFZGELT-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  2.73
• 重原子数：
  22.0
• 可旋转键数：
  9.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  67.4
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  1-octyl-2,3-dimethylimidazolium dimethylphosphate 在 高氯酸 、 溶剂黄146 作用下， 生成 C₁₃H₂₅N₂⁽¹⁺⁾*ClO₄^(1-)
  参考文献：
  名称：

  Dialkylimidazolium dimethyl phosphates as solvents and catalysts for the Knoevenagel condensation reaction

  摘要：

  The reaction between benzaldehyde and ethyl cyanoacetate is investigated in 1,3-dialkylimidazolium salts as solvents. The impact of both ions in these ionic liquids on the yield of the condensation reaction product is examined. Potentiometric titrations are employed for quantitative analyses of the best ionic liquids, revealing these to be 1,3-dialkylimidazolium dimethyl phosphates. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.02.035
• 作为产物：
  描述：

  磷酸三甲酯 、 NH118 以 乙腈 为溶剂， 反应 24.0h， 以87%的产率得到1-octyl-2,3-dimethylimidazolium dimethylphosphate
  参考文献：
  名称：

  Dialkylimidazolium dimethyl phosphates as solvents and catalysts for the Knoevenagel condensation reaction

  摘要：

  The reaction between benzaldehyde and ethyl cyanoacetate is investigated in 1,3-dialkylimidazolium salts as solvents. The impact of both ions in these ionic liquids on the yield of the condensation reaction product is examined. Potentiometric titrations are employed for quantitative analyses of the best ionic liquids, revealing these to be 1,3-dialkylimidazolium dimethyl phosphates. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.02.035