(2-mercaptobenzyl-bis-(2-pyridylmethyl)amine)Zn-ONO2 | 388083-24-7

• 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: (2-mercaptobenzyl-bis-(2-pyridylmethyl)amine)Zn-ONO2
• 英文别名: (2-Mercaptobenzyl-bis-(2-pyridylmethyl)amin)Zn-ONO2
• CAS: 388083-24-7
• 化学式: C₁₉H₁₈N₄O₃SZn
• 分子量: 447.833
• InChiKey: DTTGXTJXNALDAW-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  (2-mercaptobenzyl-bis-(2-pyridylmethyl)amine)Zn-ONO2 、 sodium thiophenolate 以 甲醇 、 水 为溶剂， 以23%的产率得到(2-Mercaptobenzyl-bis-(2-pyridylmethyl)amin)Zn-SC6H5
  参考文献：
  名称：

  Zinkkomplexe des N,N,S-Liganden 2-Mercaptobenzyl-bis-(2-pyridylmethyl)amin

  摘要：

  An improved synthesis of the title ligand MBPA-H has made its complex chemistry accessible. With diethyl zinc it forms the reactive ethyl complex (MBPA)Zn-C2H5 (1) whose reaction with phenol leads to (MBPA)Zn-OC6H5 (2). With zinc nitrate the labile compound (MBPA)Zn-ONO2 (3) is formed which in turn is converted with thiophenolate into (MBPA)Zn-SC6H5 (4). Structure determinations of 2 and 3 have confirmed severely deformed trigonal-bipyramidal coordinations of the zinc atom whose ligation patterns correspond to those in some hydrolytic zinc enzymes.

  DOI：

  10.1002/1521-3749(200111)627:11<2523::aid-zaac2523>3.0.co;2-5
• 作为产物：
  描述：

  N-(2-mercaptobenzyl)-N,N-bis(2-pyridylmethyl)amine 、 zinc(II) nitrate hexahydrate 在 CH₃ONa 作用下， 以 not given 为溶剂， 以46%的产率得到(2-mercaptobenzyl-bis-(2-pyridylmethyl)amine)Zn-ONO2
  参考文献：
  名称：

  Zinkkomplexe des N,N,S-Liganden 2-Mercaptobenzyl-bis-(2-pyridylmethyl)amin

  摘要：

  An improved synthesis of the title ligand MBPA-H has made its complex chemistry accessible. With diethyl zinc it forms the reactive ethyl complex (MBPA)Zn-C2H5 (1) whose reaction with phenol leads to (MBPA)Zn-OC6H5 (2). With zinc nitrate the labile compound (MBPA)Zn-ONO2 (3) is formed which in turn is converted with thiophenolate into (MBPA)Zn-SC6H5 (4). Structure determinations of 2 and 3 have confirmed severely deformed trigonal-bipyramidal coordinations of the zinc atom whose ligation patterns correspond to those in some hydrolytic zinc enzymes.

  DOI：

  10.1002/1521-3749(200111)627:11<2523::aid-zaac2523>3.0.co;2-5