(^tBuPCOP)IrH2 | 1449242-82-3

• 英文名称: (^tBuPCOP)IrH2
• CAS: 1449242-82-3
• 化学式: C₂₃H₄₃IrOP₂
• 分子量: 589.761
• InChiKey: FXDMFALIRGYSKB-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

• 作为产物：
  描述：

  间羟基苄基溴 在 氢气 、 sodium hydride 、 三乙基硼氢化锂 作用下， 以 四氢呋喃 、 丙酮 、 甲苯 、 正戊烷 为溶剂， 反应 94.0h， 生成 (^tBuPCOP)IrH2
  参考文献：
  名称：

  Catalytic Synthesis of n-Alkyl Arenes through Alkyl Group Cross-Metathesis

  摘要：

  n-Alkyl arenes were prepared in a one-pot tandem dehydrogenation/olefin metathesis/hydrogenation sequence directly from alkanes and ethylbenzene. Excellent selectivity was observed when ((PCP)-P-tBu)IrH2 was paired with tungsten monoaryloxide pyrrolide complexes such as W(NAr)(C3H6)(pyr)(OHIPT) (1a) [AT = 2,6-i-Pr2C6H3; pyr = pyrrolide; OHIPT = 2,6-(2,4,6-i-Pr3C6H2)(2)C6H3O]. Complex 1a was also especially active in n-octane self-metathesis, providing the highest product concentrations reported to date. The thermal stability of selected olefin metathesis catalysts allowed elevated temperatures and extended reaction times to be employed.

  DOI：

  10.1021/ja4066392
• 作为试剂：
  描述：

  正辛烷 、 乙基苯 在 W(N-2,6-iPr₂C₆H₃)(C₃H₆)(pyrrolide)(O-2,6-(2,4,6-i-Pr₃C₆H₂)₂C₆H₃) 、 (^tBuPCOP)IrH2 作用下， 反应 24.0h， 生成 十四烷 、 庚基苯 、 1-苯基辛烷
  参考文献：
  名称：

  Catalytic Synthesis of n-Alkyl Arenes through Alkyl Group Cross-Metathesis

  摘要：

  n-Alkyl arenes were prepared in a one-pot tandem dehydrogenation/olefin metathesis/hydrogenation sequence directly from alkanes and ethylbenzene. Excellent selectivity was observed when ((PCP)-P-tBu)IrH2 was paired with tungsten monoaryloxide pyrrolide complexes such as W(NAr)(C3H6)(pyr)(OHIPT) (1a) [AT = 2,6-i-Pr2C6H3; pyr = pyrrolide; OHIPT = 2,6-(2,4,6-i-Pr3C6H2)(2)C6H3O]. Complex 1a was also especially active in n-octane self-metathesis, providing the highest product concentrations reported to date. The thermal stability of selected olefin metathesis catalysts allowed elevated temperatures and extended reaction times to be employed.

  DOI：

  10.1021/ja4066392