[2-[2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanyl-4-methylphenoxy]-5-methylphenyl]-bis[3,5-bis(trifluoromethyl)phenyl]phosphane;carbanide;palladium(2+);chloride | 897074-46-3

• 英文名称: [2-[2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanyl-4-methylphenoxy]-5-methylphenyl]-bis[3,5-bis(trifluoromethyl)phenyl]phosphane;carbanide;palladium(2+);chloride
• CAS: 897074-46-3
• 化学式: C₄₇H₂₇ClF₂₄OP₂Pd
• 分子量: 1267.51
• InChiKey: NWDDTLQGJNRLBC-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  13.21
• 重原子数：
  76
• 可旋转键数：
  4
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  27

反应信息

• 作为产物：
  描述：

  chloromethyl(1,5-cyclooctadiene)palladium(II) 、 [2-[2-Bis[3,5-bis(trifluoromethyl)phenyl]phosphanyl-4-methylphenoxy]-5-methylphenyl]-bis[3,5-bis(trifluoromethyl)phenyl]phosphane 以 not given 为溶剂， 以99%的产率得到[2-[2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanyl-4-methylphenoxy]-5-methylphenyl]-bis[3,5-bis(trifluoromethyl)phenyl]phosphane;carbanide;palladium(2+);chloride
  参考文献：
  名称：

  Electronic Effect of Diphosphines on the Regioselectivity of the Palladium-Catalyzed Hydroesterification of Styrene

  摘要：

  The electronic character of the diphosphine ligands controls the regioselectivity of the Pd-catalyzed carbonylation of styrene. In the presence of electron-poor phosphines branched esters are produced and high activities of the catalytic systems are observed.

  DOI：

  10.1021/om060121t