1,1,1-trifluoro-2-morpholin-2-yl-3-phenylpropan-2-ol hydrochloride | 1357565-73-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1,1,1-trifluoro-2-morpholin-2-yl-3-phenylpropan-2-ol hydrochloride
• 英文别名: 1,1,1-Trifluoro-2-morpholin-2-yl-3-phenylpropan-2-ol;hydrochloride
• CAS: 1357565-73-1
• 化学式: C₁₃H₁₆F₃NO₂*ClH
• 分子量: 311.732
• InChiKey: IQLZXCMYCKVRPM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.93
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  41.5
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  4-苄基吗啉-2-甲腈 在 palladium on activated charcoal 、 氢气 、 magnesium 、 cesium fluoride 作用下， 以 四氢呋喃 、 甲醇 、 乙醚 、 甲苯 为溶剂， 反应 73.58h， 生成 1,1,1-trifluoro-2-morpholin-2-yl-3-phenylpropan-2-ol hydrochloride
  参考文献：
  名称：

  Synthesis and evaluation of fluorinated analogues of monoamine reuptake inhibitors

  摘要：

  The synthesis of two series of fluorinated analogues of monoamines reuptake inhibitors based on tertiary alcohols 2-substituted morpholines scaffold has been achieved through the incorporation of fluorinated substituent into 2-substituted morpholino ketones. Their binding affinities have been measured on different monoamine transporters. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2011.02.018

文献信息

• Synthesis and evaluation of fluorinated analogues of monoamine reuptake inhibitors
  作者：Christine Philippe、Julia Kaffy、Thierry Milcent、Danièle Bonnet-Delpon

  DOI：10.1016/j.jfluchem.2011.02.018

  日期：2012.2

  The synthesis of two series of fluorinated analogues of monoamines reuptake inhibitors based on tertiary alcohols 2-substituted morpholines scaffold has been achieved through the incorporation of fluorinated substituent into 2-substituted morpholino ketones. Their binding affinities have been measured on different monoamine transporters. (C) 2011 Elsevier B.V. All rights reserved.