diethyl 3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-glutarate | 1314024-57-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: diethyl 3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-glutarate
• 英文别名: Diethyl 3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)pentanedioate；diethyl 3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)pentanedioate
• CAS: 1314024-57-1
• 化学式: C₁₅H₁₅F₁₃O₄
• 分子量: 506.261
• InChiKey: YYHSVRNJKBPJET-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  32
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  17

反应信息

• 作为产物：
  描述：

  全氟庚酸甲酯 在 水 、 二异丁基氢化铝 、 三乙胺 、 乙酰氯 、 lithium chloride 作用下， 以 四氢呋喃 、 二氯甲烷 、 二甲基亚砜 为溶剂， 反应 3.08h， 生成 diethyl 3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-glutarate
  参考文献：
  名称：

  Utilization of perfluoroalkanoate-derived aluminium acetals as the convenient fluorinated aldehyde precursors

  摘要：

  Aluminium acetals from the DIBAL partial reduction of perfluoroalkanoates 1 were successfully employed as the convenient and useful fluorinated aldehyde precursors, and reactions of such intermediates with sodium salts from some beta-dicarbonyl compounds 2 as well as their possible utility as the Michael acceptors after transformation to the corresponding alkylidene malonates 8 were also demonstrated. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.05.007

文献信息

• Utilization of perfluoroalkanoate-derived aluminium acetals as the convenient fluorinated aldehyde precursors
  作者：Sumika Aoki、Tomoko Kawasaki-Takasuka、Takashi Yamazaki

  DOI：10.1016/j.tet.2011.05.007

  日期：2011.7

  Aluminium acetals from the DIBAL partial reduction of perfluoroalkanoates 1 were successfully employed as the convenient and useful fluorinated aldehyde precursors, and reactions of such intermediates with sodium salts from some beta-dicarbonyl compounds 2 as well as their possible utility as the Michael acceptors after transformation to the corresponding alkylidene malonates 8 were also demonstrated. (C) 2011 Elsevier Ltd. All rights reserved.