ethyl 2-(N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethylammonio)acetate trifluoromethanesulfonate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: ethyl 2-(N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethylammonio)acetate trifluoromethanesulfonate
• 英文别名: N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethyl-N-[(ethyloxycarbonyl)methyl]ammonium triflate；2-(N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethylammonio)acetate ethyl ester trifluoromethanesulfonate；2-(N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethylammonio)acetate ethyl ester trifluoromethanesulfonic acid；(4,6-Dimethoxy-1,3,5-triazin-2-yl)-(2-ethoxy-2-oxoethyl)-dimethylazanium;trifluoromethanesulfonate；(4,6-dimethoxy-1,3,5-triazin-2-yl)-(2-ethoxy-2-oxoethyl)-dimethylazanium;trifluoromethanesulfonate
• 化学式: CF₃O₃S*C₁₁H₁₉N₄O₄
• 分子量: 420.367
• InChiKey: UJBOYUQKPKUNHO-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  0.07
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  149
• 氢给体数：
  0
• 氢受体数：
  13

反应信息

• 作为产物：
  描述：

  N,N-二甲氨基乙酸乙酯 、 4,6-dimethoxy-2-trifluoromethylsulfonyl-1,3,5-triazine 以 四氢呋喃 为溶剂， 反应 1.0h， 以79%的产率得到ethyl 2-(N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethylammonio)acetate trifluoromethanesulfonate
  参考文献：
  名称：

  在脂肪酸盐的胶束界面上双分子脱氢缩合形成酰胺的异常速率增加。

  摘要：

  DOI：

  10.1002/anie.200502594
• 作为试剂：
  描述：

  sodium butyrate 、 正丁胺盐酸盐 在 ethyl 2-(N-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,N-dimethylammonio)acetate trifluoromethanesulfonate 作用下， 以 水 为溶剂， 生成 N-丁基丁酰胺
  参考文献：
  名称：

  DEHYDRATING CONDENSATION AGENT HAVING PROPERTY OF ACCUMULATING AT INTERFACE WITH WATER

  摘要：

  公开号：

  EP1714962B1

文献信息

• Dehydrating condensation agent having property of accumulating at interface with water
  申请人：Kunishima Munetaka

  公开号：US20070135632A1

  公开（公告）日：2007-06-14

  The present invention provides a 1,3,5-triazine compound represented by the following formula I: This compound can be synthesized easily and more economically and can be used as a dehydrating condensing agent having the property of accumulating at a water interface; In the case where carboxylic acid, amine, alcohol or other reaction substrate is amphiphilic, when mixing the dehydrating condensing agent of the present invention, which is amphiphilic, and the substrate to form various molecular aggregate phase including micelles in an aqueous solution, the substrate and the dehydrating condensing agent can be accumulated at the water interface. As a result, the concentration of the substrate increases locally at the water interface, and condensation reaction can be performed extremely efficiently.
• US7462715B2
  申请人：——

  公开号：US7462715B2

  公开（公告）日：2008-12-09