C3H3Cl3NOPt(1-)*C25H22P(1+), II | 216388-88-4

• 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: C3H3Cl3NOPt(1-)*C25H22P(1+), II
• 英文别名: Benzyl(triphenyl)phosphanium;1,2-oxazole;trichloroplatinum(1-)
• CAS: 216388-88-4
• 化学式: C₃H₃Cl₃NOPt*C₂₅H₂₂P
• 分子量: 723.925
• InChiKey: VNRPBRAZYTTXKB-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  7.92
• 重原子数：
  35
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  26
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  benzyltriphenylphosphonium platinum(II) tetrachloride 在 BF₃*Et₂O 作用下， 以 硝基甲烷 为溶剂， 以10%的产率得到C3H3Cl3NOPt(1-)*C25H22P(1+), II
  参考文献：
  名称：

  Unprecedented formation of isoxazole in the reaction between nitromethane and BF3·Et2O in the presence of ethylene

  摘要：

  The reaction in air between nitromethane and BF3. OEt2 in the presence of ethylene gives isoxazole which has been trapped by platinum(II) through reaction with (Ph-3-PCH2Ph)(2)[PtCl4] to produce the isoxazole complex (Ph-3-PCH2Ph)[PtCl3(C3H3NO)] which has been characterized spectroscopically, crystallographically and by independent synthesis.

  DOI：

  10.1039/a806251j

文献信息

• Unprecedented formation of isoxazole in the reaction between nitromethane and BF3·Et2O in the presence of ethylene
  作者：Julian A. Davies、Constanze Petersohn、Vadim Yu. Kukushkin

  DOI：10.1039/a806251j

  日期：——

  The reaction in air between nitromethane and BF3. OEt2 in the presence of ethylene gives isoxazole which has been trapped by platinum(II) through reaction with (Ph-3-PCH2Ph)(2)[PtCl4] to produce the isoxazole complex (Ph-3-PCH2Ph)[PtCl3(C3H3NO)] which has been characterized spectroscopically, crystallographically and by independent synthesis.