Mo(1-phenylcyclohexylimido)(CHCMe2Ph)[(S)-Biphen] | 929212-06-6

• 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: Mo(1-phenylcyclohexylimido)(CHCMe2Ph)[(S)-Biphen]
• 英文别名: Mo(1-phenylcyclohexylimido)(CHCMe2Ph)[(S)-3,3'-di-tert-butyl-5,5',6,6'-tetramethyl-1,1'-biphenyl-2,2'-diolate)]
• CAS: 929212-06-6
• 化学式: C₄₆H₅₉MoNO₂
• 分子量: 753.92
• InChiKey: HSVFNQMANJMIFL-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  12.76
• 重原子数：
  50.0
• 可旋转键数：
  4.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  30.82
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  (S)-3,3'-di-tert-butyl-5,5',6,6'-tetramethyl-1,1'-biphenyl-2,2'-diol 、 Mo(1-phenylcyclohexylimido)(CHCMe2Ph)(OTf)2(DME) 在 benzyl potassium 作用下， 以 四氢呋喃 、 乙醚 为溶剂， 以79%的产率得到Mo(1-phenylcyclohexylimido)(CHCMe2Ph)[(S)-Biphen]
  参考文献：
  名称：

  New Enantiomerically Pure Alkylimido Molybdenum-Based Alkylidene Complexes. Synthesis, Characterization, and Activity as Chiral Olefin Metathesis Catalysts

  摘要：

  Molybdenum olefin metathesis catalysts that contain aliphatic 1-phenylcyclohexylimido (NPhCy) and 2-phenyl-2-adamantylimido (NPhAd) groups and (S)-Biphen or (R)-Trip ligands (Biphen = 3,3'-di-tert-butyl-5,5',6,6'-tetramethyl-1,1'-biphenyl-2,2'-diolate; Trip = 3,3'-bis(2,4,6-triisopropylphenyl)-2,2'-binaphtholate) have been prepared. Their catalytic activity and enantioselectivity in desymmetrization reactions such as ring-closing metathesis of amines and lactams and ring-opening/cross-metathesis of substituted norborneols with styrene were compared to the results obtained with the only known alkylimido catalyst, Mo(NAd)(CHCMe2Ph)[(S)-Biphen]. The activities and enantioselectivities provided by these new chiral complexes vary significantly, but in virtually all instances explored were not superior to the adamantylimido analogues.

  DOI：

  10.1021/om061001o
• 作为试剂：
  描述：

  but-3-en-1-yl divinylphosphinate 在 Mo(1-phenylcyclohexylimido)(CHCMe2Ph)[(S)-Biphen] 作用下， 以 二氯甲烷 为溶剂， 反应 48.0h， 生成 、
  参考文献：
  名称：

  WO2007/57690

  摘要：

  公开号：