PhPH(O)C6H4C3H2NOMe2 | 1256265-89-0

• 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: PhPH(O)C6H4C3H2NOMe2
• 英文别名: 4,4-dimethyl-2-(2-phenylphosphonoylphenyl)-5H-1,3-oxazole
• CAS: 1256265-89-0
• 化学式: C₁₇H₁₈NO₂P
• 分子量: 299.309
• InChiKey: NIUIOPBEZJWTMF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  38.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  bis(1,5-cyclooctadiene)diiridium(I) dichloride 、 PhPH(O)C6H4C3H2NOMe2 在 NaOH 作用下， 以 甲醇 为溶剂， 生成 [(PhPH(O)C6H4C3H2NOMe2)Ir(1,5-cyclooctadiene)]
  参考文献：
  名称：

  Unprecedented Reactivity of Iridium(I) Secondary Phosphine Oxide Complexes: Formation of P-Coordinated Phosphinate Complexes by P−Aryl Bond Cleavage

  摘要：

  Aryl-iridium(III) hydride complexes with a P-coordinated phosphinate were formed from [Ir(cod)Cl](2) and secondary phosphine oxide-oxazoline ligands under basic conditions. The structure of these complexes, whose formation involved C-P cleavage, was assigned by X-ray analysis and NMR spectroscopy.

  DOI：

  10.1021/om1007874

文献信息

• Unprecedented Reactivity of Iridium(I) Secondary Phosphine Oxide Complexes: Formation of P-Coordinated Phosphinate Complexes by P−Aryl Bond Cleavage
  作者：Marc Liniger、Björn Gschwend、Markus Neuburger、Silvia Schaffner、Andreas Pfaltz

  DOI：10.1021/om1007874

  日期：2010.11.22

  Aryl-iridium(III) hydride complexes with a P-coordinated phosphinate were formed from [Ir(cod)Cl](2) and secondary phosphine oxide-oxazoline ligands under basic conditions. The structure of these complexes, whose formation involved C-P cleavage, was assigned by X-ray analysis and NMR spectroscopy.