2-phenyl-4-diphenylphosphinoyl-4H-1,3-dioxa-2-boraphenanthrene | 165333-31-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-phenyl-4-diphenylphosphinoyl-4H-1,3-dioxa-2-boraphenanthrene
• 英文别名: 4-diphenylphosphino-2-phenyl-4H-1,3,2-dioxaboraphenanthrene；diphenyl-(3-phenyl-1H-benzo[f][1,3,2]benzodioxaborinin-1-yl)phosphane
• CAS: 165333-31-3
• 化学式: C₂₉H₂₂BO₂P
• 分子量: 444.277
• InChiKey: JBAWBICYCDGLRH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.78
• 重原子数：
  33.0
• 可旋转键数：
  4.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.03
• 拓扑面积：
  18.46
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  2-phenyl-4-diphenylphosphinoyl-4H-1,3-dioxa-2-boraphenanthrene 在 1,2-naphthoquinone 作用下， 以 苯 为溶剂， 以37%的产率得到2-phenyl-4-diphenylphosphoryl-4H-1,3-dioxa-2-boraphenanthrene
  参考文献：
  名称：

  Synthesis and some properties of planar 4-diphenylphosphino-1,3,2-dioxaborinanes

  摘要：

  Fused 1,3,2-dioxaborinanes, derivatives of 4-diphenylphosphino- and 4-diphenylphosphoryl-4H-1,3-dioxa-2-boraphenanthrenes, and their complexes with amines have been synthesized. According to X-ray diffraction data, the complex of 2-phenyl-4-diphenylphosphoryl-4H-1,3-dioxa-2-boraphenanthrene with butylamine exists as a dimer due to the formation of intermolecular hydrogen bonds.

  DOI：

  10.1007/bf00697150
• 作为产物：
  描述：

  diisobutyl phenylborate 、 二苯基膦 、 2-羟基-1-萘甲醛 以 苯 为溶剂， 以70%的产率得到2-phenyl-4-diphenylphosphinoyl-4H-1,3-dioxa-2-boraphenanthrene
  参考文献：
  名称：

  Synthesis and some properties of planar 4-diphenylphosphino-1,3,2-dioxaborinanes

  摘要：

  Fused 1,3,2-dioxaborinanes, derivatives of 4-diphenylphosphino- and 4-diphenylphosphoryl-4H-1,3-dioxa-2-boraphenanthrenes, and their complexes with amines have been synthesized. According to X-ray diffraction data, the complex of 2-phenyl-4-diphenylphosphoryl-4H-1,3-dioxa-2-boraphenanthrene with butylamine exists as a dimer due to the formation of intermolecular hydrogen bonds.

  DOI：

  10.1007/bf00697150

文献信息

• Musina; Balueva; Nikonov, Russian Journal of General Chemistry, 1997, vol. 67, # 3, p. 349 - 358
  作者：Musina、Balueva、Nikonov、Starikova、Yanovskii、Musin

  DOI：——

  日期：——
• Baluewa A. S., Ajupowa E. I., Nikonow G. N., Strutschkow Ju. T., Pisarews+, Isw. AN. Ser. khim, (1994) N 9, S 1649-1655
  作者：Baluewa A. S., Ajupowa E. I., Nikonow G. N., Strutschkow Ju. T., Pisarews+

  DOI：——

  日期：——