| 960209-35-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 960209-35-2
• 化学式: C₃₅H₃₇CuN₂O₃
• 分子量: 597.236
• InChiKey: WRCUXUGJTZYEND-PVLTZIHXSA-M

计算性质

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

反应信息

• 作为产物：
  描述：

  苯甲酰甲酸 、 荚基化铜 、 1-[6-(2,6-dimethylphenyl)pyridin-2-yl]-N-[2,6-di(propan-2-yl)phenyl]ethanimine 以 not given 为溶剂， 生成
  参考文献：
  名称：

  Copper(I)−α-Ketocarboxylate Complexes:  Characterization and O₂ Reactions That Yield Copper−Oxygen Intermediates Capable of Hydroxylating Arenes

  摘要：

  A series of copper(I)-alpha-ketocarboxylate complexes have been prepared and shown to exhibit variable coordination modes of the alpha-ketocarboxylate ligand. Reaction with O-2 induces decarboxylation of this ligand, and the derived copper-oxygen intermediate(s) has been intercepted, resulting in hydroxylation of an arene substituent on the supporting N-donor ligand. Theoretical calculations have provided intriguing mechanistic notions for the process, notably implicating hydroxylation pathways that involve novel [Cu-I-OOC(O) R] and [Cu-II-O-center dot <-> CUIII=O2-](+) species.

  DOI：

  10.1021/ja0760426