dichlorobis((1-methylcyclohexyl)-η5-cyclopentadienyl)titanium | 537690-57-6

• 英文名称: dichlorobis((1-methylcyclohexyl)-η5-cyclopentadienyl)titanium
• CAS: 537690-57-6
• 化学式: C₂₄H₃₄Cl₂Ti
• 分子量: 441.32
• InChiKey: GWTMMDYUINXRLD-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

• 作为产物：
  描述：

  cyclopenta-2,4-dien-1-ylidenecyclohexane 、 甲基锂 、 四氯化钛 在 HCl 作用下， 以 乙醚 为溶剂， 以71%的产率得到dichlorobis((1-methylcyclohexyl)-η5-cyclopentadienyl)titanium
  参考文献：
  名称：

  The Effect of Open and Closed Structures of Titanocenes on the Control of Diastereoselectivity of Radical Reactions

  摘要：

  A comparison of the X-ray structures of dichlorobis{(1-methylcyclohexyl)-eta(5)-Cyclopentadienyl}-titanium (1) and dichlorobis{(1-butyl-1-methylbutyl)-eta(5)cyclopentadienyl}titanium (2), containing tertiary alkyl substituents, and the known complex dichlorobis(cyclo-hexyl-eta(5) 5-cyclopentadienyl)titanium (3), with two cyclohexyl substituents, has been carried out. The structural features are of relevance for the understanding of activity and selectivity of these complexes in diastereoselective additions of acrylates beta-titanoxy radicals and for the design of novel catalysts.

  DOI：

  10.1021/om0342208