dichloro(tris(3-di(tert-butyl)phosphinopropyl)phosphine-κ3P)ruthenium(II) | 1360110-18-4

• 分子结构分类: 有机化合物 - 有机磷化合物 - 有机膦及其衍生物
• 英文名称: dichloro(tris(3-di(tert-butyl)phosphinopropyl)phosphine-κ3P)ruthenium(II)
• 英文别名: ruthenium(2+);tris(3-ditert-butylphosphanylpropyl)phosphane;dichloride
• CAS: 1360110-18-4
• 化学式: C₃₃H₇₂Cl₂P₄Ru
• 分子量: 764.806
• InChiKey: WYEGCEVKFXQFEY-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  6.88
• 重原子数：
  40
• 可旋转键数：
  10
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂ 、 tris(3-di(tert-butyl)phosphinopropyl)phosphine 以 甲苯 为溶剂， 以55%的产率得到dichloro(tris(3-di(tert-butyl)phosphinopropyl)phosphine-κ3P)ruthenium(II)
  参考文献：
  名称：

  New Superhindered Polydentate Polyphosphine Ligands P(CH₂CH₂P^tBu₂)₃, PhP(CH₂CH₂P^tBu₂)₂, P(CH₂CH₂CH₂P^tBu₂)₃, and their Ruthenium(II) Chloride Complexes

  摘要：

  The synthesis and characterization of the extremely hindered phosphine ligands, P((CH2CH2PBu2)-Bu-t)(3) ((PP3tBu)-P-2, 1), PhP((CH2CH2PBu2)-Bu-t)(2) (PhP(2)p(2)(tBu), 2), and P((CH2CH2CH2PBu2)-Bu-t)(3) ((PP3tBu)-P-3, 3) are reported, along with the synthesis and characterization of ruthenium chloro complexes RuCl2((PP3tBu)-P-2) (4), RuCl2((PhPP2tBu)-P-2) (5), and RuCl2((PP3tBu)-P-3) (6). The bulky (PP3tBu)-P-2 (1) and (PP3tBu)-P-3 (3) ligands are the most sterically encumbered PP3-type ligands so far synthesized, and in all cases, only three phosphorus donors are able to bind to the metal center. Complexes RuCl2((PhPP2tBu)-P-2) (5) and RuCl2((PP3tBu)-P-3) (6) were characterized by crystallography. Low temperature solution and solid state P-31{H-1} NMR were used to demonstrate that the structure of RuCl2((PP3tBu)-P-3) (4) is probably analogous to that of RuCl2((PP3tBu)-P-3) (5) which had been structurally characterized.

  DOI：

  10.1021/ic2027169