4,4,14,14-Tetrafluoro-6,12-diphenyl-5,13-dioxa-1,3-diazonia-4,14-diboranuidatricyclo[8.4.0.03,8]tetradeca-1(10),2,6,8,11-pentaene | 1446022-23-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: 4,4,14,14-Tetrafluoro-6,12-diphenyl-5,13-dioxa-1,3-diazonia-4,14-diboranuidatricyclo[8.4.0.03,8]tetradeca-1(10),2,6,8,11-pentaene
• 英文别名: 4,4,14,14-tetrafluoro-6,12-diphenyl-5,13-dioxa-1,3-diazonia-4,14-diboranuidatricyclo[8.4.0.03,8]tetradeca-1(10),2,6,8,11-pentaene
• CAS: 1446022-23-6
• 化学式: C₂₀H₁₄B₂F₄N₂O₂
• 分子量: 411.959
• InChiKey: MSBNUYXKMSCSEK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.76
• 重原子数：
  30
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  26.2
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  苯乙酮 在 三氟化硼乙醚 、 sodium hydride 、 三乙胺 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 84.0h， 生成 4,4,14,14-Tetrafluoro-6,12-diphenyl-5,13-dioxa-1,3-diazonia-4,14-diboranuidatricyclo[8.4.0.03,8]tetradeca-1(10),2,6,8,11-pentaene
  参考文献：
  名称：

  Synthesis and Fluorescence Properties of Pyrimidine Mono- and Bisboron Complexes

  摘要：

  Novel fluorescent mono- and bisboron complexes based on pyrimidine bearing beta-iminoenolate ligands were synthesized, and their fluorescence properties were investigated. The nonsubstituted and trifluoromethyl-substituted monoboron complexes showed higher fluorescence quantum yield in solid state than in solution. The dimethylamino derivative of the monoboron complex exhibited positive solvatochromism in the fluorescence spectra. The bisboron complex showed significantly higher molar absorption coefficient and red-shifted maximum absorption and maximum fluorescence wavelengths than the corresponding monoboron complex.

  DOI：

  10.1021/jo400879g

文献信息

• Synthesis and Fluorescence Properties of Pyrimidine Mono- and Bisboron Complexes
  作者：Yasuhiro Kubota、Yousuke Ozaki、Kazumasa Funabiki、Masaki Matsui

  DOI：10.1021/jo400879g

  日期：2013.7.19

  Novel fluorescent mono- and bisboron complexes based on pyrimidine bearing beta-iminoenolate ligands were synthesized, and their fluorescence properties were investigated. The nonsubstituted and trifluoromethyl-substituted monoboron complexes showed higher fluorescence quantum yield in solid state than in solution. The dimethylamino derivative of the monoboron complex exhibited positive solvatochromism in the fluorescence spectra. The bisboron complex showed significantly higher molar absorption coefficient and red-shifted maximum absorption and maximum fluorescence wavelengths than the corresponding monoboron complex.