trans-dichlorobis(diphenyl(2,4,6-trimethylbenzyl)phosphine)palladium(II) | 913724-90-0

• 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: trans-dichlorobis(diphenyl(2,4,6-trimethylbenzyl)phosphine)palladium(II)
• 英文别名: Dichloropalladium;diphenyl-[(2,4,6-trimethylphenyl)methyl]phosphane
• CAS: 913724-90-0
• 化学式: C₄₄H₄₆Cl₂P₂Pd
• 分子量: 814.123
• InChiKey: FOUQENNHEVGCGK-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  11.87
• 重原子数：
  49
• 可旋转键数：
  8
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  diphenyl(2,4,6-trimethylbenzyl)phosphine 、 dichloro(cycloocta-1,5-diene)palladium (II) 以 二氯甲烷 为溶剂， 以80%的产率得到trans-dichlorobis(diphenyl(2,4,6-trimethylbenzyl)phosphine)palladium(II)
  参考文献：
  名称：

  Square-planar dichloro palladium complexes with trans-configurated phosphine ligands avoiding ortho-metallation: Ligand design, complex synthesis, molecular structure and catalytic potential for Suzuki cross-coupling reactions

  摘要：

  The square-planar palladium complexes trans-[PdCl2(PPh2-CH2-2,4,6-C6H2Me3)(2)] (1) and trans-[PdCl2(eta(2)-PPh2-CH2-2,4,6-C6HMe3-CH2-2,4,6-C6HMe3-CH2-PPh2)] (2) have been synthesized from [PdCl2(cod)] (cod = 1,5-cyclooctadiene) and the corresponding new phosphine or diphosphine ligands. The single-crystal X-ray structure analysis reveals for both complexes a trans arrangement of the two chlorine and of the two phosphorus atoms. In both cases, ortho-metallation leading to palladacycles is not possible, since all ortho positions in the benzylic rings of I and 2 are blocked by methyl substituents. Both complexes are found to catalyze Suzuki cross-coupling reactions of deactivated and even bulky arene substrates. (c) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2006.06.020
• 作为试剂：
  描述：

  对溴甲苯 、 苯硼酸 在 trans-dichlorobis(diphenyl(2,4,6-trimethylbenzyl)phosphine)palladium(II) potassium carbonate 作用下， 以 甲苯 为溶剂， 反应 18.0h， 生成 联苯
  参考文献：
  名称：

  Square-planar dichloro palladium complexes with trans-configurated phosphine ligands avoiding ortho-metallation: Ligand design, complex synthesis, molecular structure and catalytic potential for Suzuki cross-coupling reactions

  摘要：

  The square-planar palladium complexes trans-[PdCl2(PPh2-CH2-2,4,6-C6H2Me3)(2)] (1) and trans-[PdCl2(eta(2)-PPh2-CH2-2,4,6-C6HMe3-CH2-2,4,6-C6HMe3-CH2-PPh2)] (2) have been synthesized from [PdCl2(cod)] (cod = 1,5-cyclooctadiene) and the corresponding new phosphine or diphosphine ligands. The single-crystal X-ray structure analysis reveals for both complexes a trans arrangement of the two chlorine and of the two phosphorus atoms. In both cases, ortho-metallation leading to palladacycles is not possible, since all ortho positions in the benzylic rings of I and 2 are blocked by methyl substituents. Both complexes are found to catalyze Suzuki cross-coupling reactions of deactivated and even bulky arene substrates. (c) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2006.06.020

文献信息

• Square-planar dichloro palladium complexes with trans-configurated phosphine ligands avoiding ortho-metallation: Ligand design, complex synthesis, molecular structure and catalytic potential for Suzuki cross-coupling reactions
  作者：Ludovic Chahen、Bruno Therrien、Georg Süss-Fink

  DOI：10.1016/j.jorganchem.2006.06.020

  日期：2006.10

  The square-planar palladium complexes trans-[PdCl2(PPh2-CH2-2,4,6-C6H2Me3)(2)] (1) and trans-[PdCl2(eta(2)-PPh2-CH2-2,4,6-C6HMe3-CH2-2,4,6-C6HMe3-CH2-PPh2)] (2) have been synthesized from [PdCl2(cod)] (cod = 1,5-cyclooctadiene) and the corresponding new phosphine or diphosphine ligands. The single-crystal X-ray structure analysis reveals for both complexes a trans arrangement of the two chlorine and of the two phosphorus atoms. In both cases, ortho-metallation leading to palladacycles is not possible, since all ortho positions in the benzylic rings of I and 2 are blocked by methyl substituents. Both complexes are found to catalyze Suzuki cross-coupling reactions of deactivated and even bulky arene substrates. (c) 2006 Elsevier B.V. All rights reserved.