N,N,N-triisopropyl-1,4,7-triazacyclononane copper(II)(C6H5C9H4O3) perchlorate | 798550-69-3

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 2-芳基苯并呋喃类黄酮
• 英文名称: N,N,N-triisopropyl-1,4,7-triazacyclononane copper(II)(C6H5C9H4O3) perchlorate
• CAS: 798550-69-3
• 化学式: C₃₀H₄₂CuN₃O₃*ClO₄
• 分子量: 655.678
• InChiKey: JZJDNAYAIKVQBH-UHFFFAOYSA-L

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：

  N,N,N-triisopropyl-1,4,7-triazacyclononane copper(II)(C6H5C9H4O3) perchlorate 、 氧气 以 N,N-二甲基甲酰胺 为溶剂， 生成 N,N,N-triisopropyl-1,4,7-triazacyclononane (O-benzoylsalicylato)copper(II) perchlorate
  参考文献：
  名称：

  The Reaction of μ‐η ² :η ² ‐Peroxo‐ and Bis(μ‐oxo)dicopper Complexes with Flavonol

  摘要：

  AbstractThe [Cu2(μ‐O)2]2+ and [Cu2(μ‐η2:η2‐O)2]2+ motifs with coordinated N,N,N‐tribenzyl‐1,4,7‐triazacyclononane and N,N,N‐triisopropyl‐1,4,7‐triazacyclononane auxiliary ligands in their reaction with flavonol do not lead to ring scission products of the heterocycle, but the formation of the corresponding (flavonolato)copper(II) complexes [Cu(fla)(Bz‐TAC)]ClO4 and [Cu(fla)(iPr‐TAC)]ClO4. The subsequent oxygenolysis of the coordinated flavonolate ligand leads to O‐benzoylsalicylate at elevated temperature, resulting in the enzyme mimicking products [Cu(O‐bs)(Bz‐TAC)]ClO4, [Cu(O‐bs)(iPr‐TAC)]ClO4) as well as carbon monoxide. The X‐ray structures of [Cu(fla)(Bz‐TAC)]ClO4, [Cu(O‐bs)(Bz‐TAC)]ClO4, and [Cu(O‐bs)(iPr‐TAC)]ClO4) are presented. (© Wiley‐VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2004)

  DOI：

  10.1002/ejic.200300605
• 作为产物：
  描述：

  3-羟基黄酮 、 bis(N,N,N-triisopropyl-1,4,7-triazacyclononane) bis(μ-oxo)dicopper(II) perchlorate 以 二氯甲烷 为溶剂， 以90%的产率得到N,N,N-triisopropyl-1,4,7-triazacyclononane copper(II)(C6H5C9H4O3) perchlorate
  参考文献：
  名称：

  The Reaction of μ‐η ² :η ² ‐Peroxo‐ and Bis(μ‐oxo)dicopper Complexes with Flavonol

  摘要：

  AbstractThe [Cu2(μ‐O)2]2+ and [Cu2(μ‐η2:η2‐O)2]2+ motifs with coordinated N,N,N‐tribenzyl‐1,4,7‐triazacyclononane and N,N,N‐triisopropyl‐1,4,7‐triazacyclononane auxiliary ligands in their reaction with flavonol do not lead to ring scission products of the heterocycle, but the formation of the corresponding (flavonolato)copper(II) complexes [Cu(fla)(Bz‐TAC)]ClO4 and [Cu(fla)(iPr‐TAC)]ClO4. The subsequent oxygenolysis of the coordinated flavonolate ligand leads to O‐benzoylsalicylate at elevated temperature, resulting in the enzyme mimicking products [Cu(O‐bs)(Bz‐TAC)]ClO4, [Cu(O‐bs)(iPr‐TAC)]ClO4) as well as carbon monoxide. The X‐ray structures of [Cu(fla)(Bz‐TAC)]ClO4, [Cu(O‐bs)(Bz‐TAC)]ClO4, and [Cu(O‐bs)(iPr‐TAC)]ClO4) are presented. (© Wiley‐VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2004)

  DOI：

  10.1002/ejic.200300605