[zinc(imidazole)(H2O)((+)-N-tosyl-L-glutamate)] | 1431535-96-4

• 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: [zinc(imidazole)(H2O)((+)-N-tosyl-L-glutamate)]
• 英文别名: [Zn(Him)(H2O)(CH3C6H4SO2NHCH(COO)(CH2)2COO)]
• CAS: 1431535-96-4
• 化学式: C₃H₄N₂*C₁₂H₁₃NO₆S*H₂O*Zn
• 分子量: 450.788
• InChiKey: IJVPFNQPBGSRIW-KAFJHEIMSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  -2.5
• 重原子数：
  27.0
• 可旋转键数：
  7.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  186.61
• 氢给体数：
  2.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  咪唑 、 N-对甲苯磺酰-L-谷氨酸 、 zinc(II) acetate dihydrate 在 sodium hydroxide 作用下， 以 甲醇 、 水 为溶剂， 反应 0.17h， 以56%的产率得到[zinc(imidazole)(H2O)((+)-N-tosyl-L-glutamate)]
  参考文献：
  名称：

  Self-assembly of two one-dimensional zinc polymers based on (+)-N-tosyl-l-glutamic acid

  摘要：

  Two novel zinc (II) coordination polymers [Zn(Him)(H2O)(L)](n) (1) and {[Zn(2,4'-bipy)(H2O)](L)}(n) (2) (H2L = (+)-N-tosyl-L-glutamic acid, Him = imidazole, and 2,4'-bipy = 2,4'-bipyridine) were synthesized and then structurally characterized by elemental, infrared, thermogravimetric, and X-ray crystallography analyses. Compound 1 crystallized in the chiral space group P2(1) and had a ladder-like one-dimensional double-chain structure. Compound 2 crystallized in the achiral space group P2(1)/c and had a one-dimensional single-chain framework. Both compounds assembled to form two-dimensional supramolecular structures through hydrogen-bonding interactions. The two compounds also showed intense fluorescence at room temperature. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2012.12.031