{difluoro(1,10-phenanthroline)boronium}BF4 | 62598-27-0

• 英文名称: {difluoro(1,10-phenanthroline)boronium}BF4
• CAS: 62598-27-0
• 化学式: BF₄*C₁₂H₈BF₂N₂
• 分子量: 315.821
• InChiKey: MSQIPUKKHMDJEJ-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

• 作为反应物：
  描述：

  {difluoro(1,10-phenanthroline)boronium}BF4 、 二甲基亚砜 以 二甲基亚砜 为溶剂， 生成 trifluoroborane-dimethylsulfoxide
  参考文献：
  名称：

  Chelated fluoroboron cations

  摘要：

  Possible methods of formation of chelated fluoroboron cations (DD)BF2+ and (DD)BFX+, where DD is 2,2'-bipyridine (bpy), 1,10-phenanthroline (1,10-phen), 2,2',6',2"-terpyridine (terpy) and 1,8-bis(dimethylamino) naphthalene (DMAN, 'proton sponge'), have been investigated, primarily by F-19 and B-11 NMR and fast atom bombardment mass spectrometry. The most successful method involves displacement of weakly basic isoxazole (ISOX) and heavy halide ion from ISOX . BF2X and ISOX . BFX2 (X = Cl, Br). Displacement of pyridine from py . BF2Cl and py . BFCl2 is less effective because pyridine, more basic than isoxazole, competes with the chelating donor in forming fluoroboron cations when displaced from its adducts. 1,10-Phen, terpy and DMAN form (DD)BF2+ . BF4- when reacted with Et2O . BF3 or with ISOX . BF3 under our conditions, but bpy does not. None of these chelating ligands can displace pyridine from (py)(2)BF2+ . PF6- under conditions that are effective with tertiary-amine chelating donors. (1,10-Phen)BF2+ but not the other (DD)BF2+ species is attacked by dimethylsulfoxide (DMSO), to form first (DMSO)(2)BF2+ and finally DMSO . BF3. (C) 2000 Elsevier Science Ltd All rights reserved.

  DOI：

  10.1016/s0277-5387(99)00339-3
• 作为产物：
  描述：

  1,10-菲罗啉 、 isoxazole*BF4 以 氯仿 为溶剂， 生成 {difluoro(1,10-phenanthroline)boronium}BF4
  参考文献：
  名称：

  Chelated fluoroboron cations

  摘要：

  Possible methods of formation of chelated fluoroboron cations (DD)BF2+ and (DD)BFX+, where DD is 2,2'-bipyridine (bpy), 1,10-phenanthroline (1,10-phen), 2,2',6',2"-terpyridine (terpy) and 1,8-bis(dimethylamino) naphthalene (DMAN, 'proton sponge'), have been investigated, primarily by F-19 and B-11 NMR and fast atom bombardment mass spectrometry. The most successful method involves displacement of weakly basic isoxazole (ISOX) and heavy halide ion from ISOX . BF2X and ISOX . BFX2 (X = Cl, Br). Displacement of pyridine from py . BF2Cl and py . BFCl2 is less effective because pyridine, more basic than isoxazole, competes with the chelating donor in forming fluoroboron cations when displaced from its adducts. 1,10-Phen, terpy and DMAN form (DD)BF2+ . BF4- when reacted with Et2O . BF3 or with ISOX . BF3 under our conditions, but bpy does not. None of these chelating ligands can displace pyridine from (py)(2)BF2+ . PF6- under conditions that are effective with tertiary-amine chelating donors. (1,10-Phen)BF2+ but not the other (DD)BF2+ species is attacked by dimethylsulfoxide (DMSO), to form first (DMSO)(2)BF2+ and finally DMSO . BF3. (C) 2000 Elsevier Science Ltd All rights reserved.

  DOI：

  10.1016/s0277-5387(99)00339-3

文献信息

• Solvolysis of the difluoro(1,10-phenantholine)boronium cation in DMSO: A11B and19F NMR study
  作者：Klaus R. Koch、Susanne Madelung

  DOI：10.1016/s0277-5387(00)86143-4

  日期：1991.1

  Abstract The salts [LLBF2]+ BF4−, where LL = 1,10-phenantholine and 2,2′-bipyridine, undergo solvolysis in DMSO solution. The rate of solvolysis of the difluoro(1,10-phenantholine)boronium cation may conveniently be followed by means of11B and19F NMR. In contrast, the difluoro(2,2′-bipyridine)boronium cation appears to be rapidly solvolysed on dissolution, highlighting the differences in stabilities

  摘要LL = 1,10-菲咯啉和2,2'-联吡啶的盐[LLBF2] + BF4-在溶剂中溶于DMSO溶液中。二氟（1,10-菲咯啉）硼阳离子的溶剂分解速率可以方便地通过11B和19F NMR进行跟踪。相反，二氟（2,2'-联吡啶）硼阳离子似乎在溶解时迅速溶剂化，突显了这两种硼阳离子的稳定性差异。