N,N',N''-1,3,5-triazine-2,4,6-triyltrisglutamic acid | 1383425-64-6

• 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: N,N',N''-1,3,5-triazine-2,4,6-triyltrisglutamic acid
• 英文别名: 2-[[4,6-Bis(1,3-dicarboxypropylamino)-1,3,5-triazin-2-yl]amino]pentanedioic acid
• CAS: 1383425-64-6
• 化学式: C₁₈H₂₄N₆O₁₂
• 分子量: 516.422
• InChiKey: PUSNSLIOJATXJW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.6
• 重原子数：
  36
• 可旋转键数：
  18
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  299
• 氢给体数：
  9
• 氢受体数：
  18

反应信息

• 作为产物：
  描述：

  三聚氯氰 、 DL-谷氨酸 在 sodium hydroxide 、 盐酸 作用下， 以 水 为溶剂， 以87%的产率得到N,N',N''-1,3,5-triazine-2,4,6-triyltrisglutamic acid
  参考文献：
  名称：

  Microwave-assisted SNAr reaction of 2,4,6-trichloro-1,3,5-triazine for the rapid synthesis of C3-symmetrical polycarboxylate ligands

  摘要：

  The microwave-assisted SNAr reaction of 2,4,6-trichloro-1,3,5-triazine with various unprotected amino acids was developed for the synthesis of C-3-symmetrical polycarboxylate ligands which can be used as structural directing units in metal-organic frameworks. The reactions were performed in water using a domestic microwave oven as the heating device. In comparison to the reactions performed under conventional heating, the reactions under microwave irradiation proceeded much more rapidly within 20 min to afford the desired ligands in comparative yields to those obtained by conventional heating. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.04.124