bis[4-phenyl-2-oxazoline]methylene propyltriethoxysilane | 879207-71-3

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: bis[4-phenyl-2-oxazoline]methylene propyltriethoxysilane
• 英文别名: bis[4-phenyl-2-oxazoline]methylenepropyltriethoxysilane；C3BoxPh
• CAS: 879207-71-3
• 化学式: C₂₈H₃₈N₂O₅Si
• 分子量: 510.706
• InChiKey: DOZZRBVOBSGBQP-UIOOFZCWSA-N

物化性质

• 沸点：
  564.6±50.0 °C(Predicted)
• 密度：
  1.14±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.77
• 重原子数：
  36.0
• 可旋转键数：
  14.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  70.87
• 氢给体数：
  0.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  四氢呋喃 、 bis[4-phenyl-2-oxazoline]methylene propyltriethoxysilane 、 1,5-cyclooctadienebis(tetrahydrofuran)rhodium(I) tetrafluoroborate 以 四氢呋喃 为溶剂， 生成 [Rh(I)(bis[4-phenyl-2-oxazoline]methylene propyltriethoxysilane)(1,5-cyclooctadiene)][BF4]*n(tetrahydrofuran)
  参考文献：
  名称：

  New chiral oxazoline based-rhodium(I) catalysts: Synthesis, characterisation, heterogeneisation and applications

  摘要：

  New chiral oxazoline-based rhodium(l) homogeneous and heterogeneous catalysts have been prepared and fully characterised through H-1 and C-13 NMR, CP-MAS NMR and XPS. The method used for anchoring the catalyst onto silica was found particularly suitable, since the organometallic complexes remained unchanged over the procedure. The catalysts exhibited a moderate activity and enantioselectivity in hydrogenation of C=O and C=C double bond. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2005.10.016
• 作为产物：
  描述：

  D-苯甘氨醇 在 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 、 二氯甲烷 为溶剂， 反应 42.0h， 生成 bis[4-phenyl-2-oxazoline]methylene propyltriethoxysilane
  参考文献：
  名称：

  New chiral oxazoline based-rhodium(I) catalysts: Synthesis, characterisation, heterogeneisation and applications

  摘要：

  New chiral oxazoline-based rhodium(l) homogeneous and heterogeneous catalysts have been prepared and fully characterised through H-1 and C-13 NMR, CP-MAS NMR and XPS. The method used for anchoring the catalyst onto silica was found particularly suitable, since the organometallic complexes remained unchanged over the procedure. The catalysts exhibited a moderate activity and enantioselectivity in hydrogenation of C=O and C=C double bond. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2005.10.016