C6H3OH(4-NO2)(CH=NCH2-C10H15) | 211686-81-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: C6H3OH(4-NO2)(CH=NCH2-C10H15)
• CAS: 211686-81-6
• 化学式: C₁₈H₂₂N₂O₃
• 分子量: 314.384
• InChiKey: RUTHJMXVFKPVOT-WXZYKRPKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.94
• 重原子数：
  23.0
• 可旋转键数：
  4.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  75.73
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  C6H3OH(4-NO2)(CH=NCH2-C10H15) 以 四氢呋喃 、 苯 为溶剂， 生成 RuCl(tricyclohexylphosphine)(=CHPh)(OC6H3(4-NO2)CHNCH2-C10H15)
  参考文献：
  名称：

  Synthesis and Characterization of New Ruthenium-Based Olefin Metathesis Catalysts Coordinated with Bidentate Schiff-Base Ligands

  摘要：

  A novel series of Schiff-base-substituted ruthenium carbene complexes have been prepared by the treatment of RuCl2(=CHPh)(PCy3)(2) with a variety of Schiff-base ligands as the thallium salts. Modification of the Schiff-base electronic and/or structural substituents allowed for the tuning of the complexes activities in olefin metathesis reactions. The structures of the complexes were unambiguously characterized by NMR studies and X-ray analysis. These newly prepared complexes are highly stable to air, moisture, and temperature and even exhibit catalytic activity in polar protic solvents.

  DOI：

  10.1021/om970910y