[Pd(methyl)(diethylether)(phenacyldi-tert-butylphosphine-P,O)][B(3,5-C6H3(CF3)2)4] | 446033-21-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [Pd(methyl)(diethylether)(phenacyldi-tert-butylphosphine-P,O)][B(3,5-C6H3(CF3)2)4]
• 英文别名: carbanide;2-ditert-butylphosphanyl-1-phenylethanone;ethoxyethane;palladium(2+);tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide
• CAS: 446033-21-2
• 化学式: C₂₁H₃₈O₂PPd*C₃₂H₁₂BF₂₄
• 分子量: 1323.15
• InChiKey: FNRHWUCVPOZKMK-UHFFFAOYSA-N

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

• 作为反应物：
  描述：

  乙烯 、 [Pd(methyl)(diethylether)(phenacyldi-tert-butylphosphine-P,O)][B(3,5-C6H3(CF3)2)4] 以 二氯甲烷 为溶剂， 生成 [(κ2-P,O-phenacyldi-tert-butylphosphine)Pd(CH3)(η2-C2H4)][B((CF3)2C6H3)4]
  参考文献：
  名称：

  Structural Characterization of [κ²-(t-Bu)₂PCH₂C(O)C₆H₅]PdMe(η²-C₂H₄)⁺BAr‘₄^-:  A Model for the Catalyst Resting State for Ethylene Polymerization

  摘要：

  The Pd methyl-ethylene complex (PO)Pd-Me(eta(2)-C2H4)+BAr'(-)(4) (PO) = phenacyldi-tert-butylphosphine; Ar' = 3,5-(CF3)(2)C6H3 has been isolated and structurally characterized by X-ray crystallography. The ethylene ligand is oriented perpendicular to the square plane and is cis to the methyl ligand. This compound closely models the resting state(s) for ethylene oligomerization/polymerization by such complexes.

  DOI：

  10.1021/om020951g
• 作为产物：
  描述：

  四(3,5-二(三氟甲基)苯基)硼酸钠 、 PdCl(methyl)(phenacyldi-tert-butylphosphine-P,O) 以 乙醚 为溶剂， 生成 [Pd(methyl)(diethylether)(phenacyldi-tert-butylphosphine-P,O)][B(3,5-C6H3(CF3)2)4]
  参考文献：
  名称：

  Structural Characterization of [κ²-(t-Bu)₂PCH₂C(O)C₆H₅]PdMe(η²-C₂H₄)⁺BAr‘₄^-:  A Model for the Catalyst Resting State for Ethylene Polymerization

  摘要：

  The Pd methyl-ethylene complex (PO)Pd-Me(eta(2)-C2H4)+BAr'(-)(4) (PO) = phenacyldi-tert-butylphosphine; Ar' = 3,5-(CF3)(2)C6H3 has been isolated and structurally characterized by X-ray crystallography. The ethylene ligand is oriented perpendicular to the square plane and is cis to the methyl ligand. This compound closely models the resting state(s) for ethylene oligomerization/polymerization by such complexes.

  DOI：

  10.1021/om020951g

文献信息

• Ethylene Polymerization and Ethylene/Methyl 10-Undecenoate Copolymerization Using Nickel(II) and Palladium(II) Complexes Derived from a Bulky P,O Chelating Ligand
  作者：Weijun Liu、Jon M. Malinoski、Maurice Brookhart

  DOI：10.1021/om0201516

  日期：2002.7.1

  Cationic Ni(II) and Pd(II) complexes based on the bulky P,O ligand phenacyldi-tert-butylphosphine have been shown to be active for the polymerization of ethylene and copolymerization of ethylene and methyl 10-undecenoate, a functionalized monomer.

  已显示基于庞大的P，O配体苯甲酰基二叔丁基膦的阳离子Ni（II）和Pd（II）络合物对于乙烯的聚合以及乙烯与10-十一碳烯酸酯（一种官能化的单体）的共聚合具有活性。