[Zr4Al2(μ4-O)2(μ-OEt)12Cl6] | 457093-71-9

• 英文名称: [Zr4Al2(μ4-O)2(μ-OEt)12Cl6]
• CAS: 457093-71-9
• 化学式: C₂₄H₆₀Al₂Cl₆O₁₄Zr₄
• 分子量: 1204.31
• InChiKey: CAPAAEQPQFWJSU-UHFFFAOYSA-H

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

• 作为产物：
  描述：

  氯化锆(IV) 、 zirconium(IV) ethoxide 、 氢化铝 以 四氢呋喃 、 乙醇 为溶剂， 以23%的产率得到[Zr4Al2(μ4-O)2(μ-OEt)12Cl6]
  参考文献：
  名称：

  Trapping of AlMe₃ with the Oxygen Atom of the Zr₃(μ₃-O) Unit

  摘要：

  We report for the first time the direct complexation of AlMe3 by a Zr-3(mu(3)-O) core. The precursor [Zr-4(mu(4)-O)(mu-OMe)(6)Cl-8(thf)(4)] (1) was obtained in the direct reaction of ZrCl4 with methanol. When 1 was allowed to react with AlMe3, [Zr3Al(mu(4)-O)(mu-OMe)(6)Cl-6(Me)(thf)(3)] (2) was isolated. An analogous trend was observed in the compound [Zr4Al2(mu(4)-O)(2)(OEt)(12)Cl-6] (3), which was obtained in the direct reaction of ZrCl4 with Zr(OEt)(4) and Al in thf/EtOH.

  DOI：

  10.1021/om020258t