(S^*,R^*)-4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-1-phenyl-N-(1-phenylethyl)-1-heptylamine | 137967-46-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: (S^*,R^*)-4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-1-phenyl-N-(1-phenylethyl)-1-heptylamine
• 英文别名: (1R)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-phenyl-N-[(1S)-1-phenylethyl]heptan-1-amine
• CAS: 137967-46-5
• 化学式: C₂₁H₁₆F₁₃N
• 分子量: 529.344
• InChiKey: HBLKTDKFQNVCGY-SWLSCSKDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.7
• 重原子数：
  35
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  12
• 氢给体数：
  1
• 氢受体数：
  14

反应信息

• 作为产物：
  描述：

  α-苯乙胺 在 4 A molecular sieve 、 三氟化硼乙醚 、 甲基锂 、 lithium bromide 作用下， 以 乙醚 、 苯 为溶剂， 反应 1.0h， 生成 (S^*,R^*)-4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-1-phenyl-N-(1-phenylethyl)-1-heptylamine
  参考文献：
  名称：

  Boron trifluoride-assisted perfluoroalkylation of carbon-nitrogen double bonds

  摘要：

  In the presence of BF3.OEt2, (perfluoroalkyl)lithiums generated in situ from the reaction of primary perfluoroalkyl iodides and MeLi-LiBr reacted with imines, azines, and nitrones to afford perfluoroalkylated nitrogen-containing compounds in moderate to good yields. This method was successfully applied to the preparation of a (perfluoroalkyl)glycine and optically active perfluoroalkylated amines.

  DOI：

  10.1021/jo00031a032

文献信息

• Boron trifluoride-assisted perfluoroalkylation of carbon-nitrogen double bonds
  作者：Hidemitsu Uno、Shinichiro Okada、Tetsushi Ono、Yasukazu Shiraishi、Hitomi Suzuki

  DOI：10.1021/jo00031a032

  日期：1992.2

  In the presence of BF3.OEt2, (perfluoroalkyl)lithiums generated in situ from the reaction of primary perfluoroalkyl iodides and MeLi-LiBr reacted with imines, azines, and nitrones to afford perfluoroalkylated nitrogen-containing compounds in moderate to good yields. This method was successfully applied to the preparation of a (perfluoroalkyl)glycine and optically active perfluoroalkylated amines.