difluoro-[2-[fluoro(diphenyl)silyl]phenyl]-phenylsilane | 138914-12-2

• 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: difluoro-[2-[fluoro(diphenyl)silyl]phenyl]-phenylsilane
• CAS: 138914-12-2
• 化学式: C₂₄H₁₉F₃Si₂
• 分子量: 420.581
• InChiKey: LRFHGLZARNQODA-UHFFFAOYSA-N

物化性质

• 沸点：
  457.1±37.0 °C(Predicted)
• 密度：
  1.18±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.12
• 重原子数：
  29.0
• 可旋转键数：
  5.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  0.0

反应信息

• 作为反应物：
  描述：

  、 difluoro-[2-[fluoro(diphenyl)silyl]phenyl]-phenylsilane 以 丙酮 为溶剂， 生成 二苯基二氟硅烷 、
  参考文献：
  名称：

  Anion complexation by bidentate Lewis acidic hosts, ortho-bis(fluorosilyl) benzenes

  摘要：

  Ortho-bis(fluorosilyl)benzenes, precursors for bis-siliconates, o-C6H4(SiPhF(2))(2) (1), o-C6H4(SiF3)(SiPh(2)F) (2) and o-C6H4(SiPhF(2))(SiPh(2)F) (3), possess anion binding properties as bidentate Lewis acidic hosts in organic solvents. Compound 1 quantitatively binds a fluoride ion from KF suspended in acetone or tetrahydrofuran without support of 18-crown-6 to form the corresponding soluble bis-siliconate [o-C6H4(SiPhF(2))(2)F]K (4). The binding constants of a series of fluorosilanes for a fluoride ion are measured by H-1 and F-19 NMR spectroscopies. The affinity of fluorosilanes towards a fluoride ion increases in the order PhMeSiF(2) (7) < Ph(2)SiF(2) (9) < 3 < 1 < 2. The fluoride ion binding constant of 2 is estimated to be K > 1.1 x 10(9) M(-1) at 193 K. These bidentate Lewis acids 1-3 are among the strongest organic hosts for a fluoride ion in organic solvents ever reported.

  DOI：

  10.1016/0022-328x(95)05636-4
• 作为产物：
  描述：

  [2-[二氟(苯基)甲硅烷基]苯基]-二氟-苯基硅烷 、 以 丙酮 为溶剂， 生成 difluoro-[2-[fluoro(diphenyl)silyl]phenyl]-phenylsilane 、 C₁₈H₁₄F₅Si₂^(1-)*C₁₂H₂₄O₆*K⁽¹⁺⁾
  参考文献：
  名称：

  Anion complexation by bidentate Lewis acidic hosts, ortho-bis(fluorosilyl) benzenes

  摘要：

  Ortho-bis(fluorosilyl)benzenes, precursors for bis-siliconates, o-C6H4(SiPhF(2))(2) (1), o-C6H4(SiF3)(SiPh(2)F) (2) and o-C6H4(SiPhF(2))(SiPh(2)F) (3), possess anion binding properties as bidentate Lewis acidic hosts in organic solvents. Compound 1 quantitatively binds a fluoride ion from KF suspended in acetone or tetrahydrofuran without support of 18-crown-6 to form the corresponding soluble bis-siliconate [o-C6H4(SiPhF(2))(2)F]K (4). The binding constants of a series of fluorosilanes for a fluoride ion are measured by H-1 and F-19 NMR spectroscopies. The affinity of fluorosilanes towards a fluoride ion increases in the order PhMeSiF(2) (7) < Ph(2)SiF(2) (9) < 3 < 1 < 2. The fluoride ion binding constant of 2 is estimated to be K > 1.1 x 10(9) M(-1) at 193 K. These bidentate Lewis acids 1-3 are among the strongest organic hosts for a fluoride ion in organic solvents ever reported.

  DOI：

  10.1016/0022-328x(95)05636-4