dimethyl 3-(3-fluorobut-1-en-2-yl)cyclopent-3-ene-1,1-dicarboxylate | 1610622-46-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: dimethyl 3-(3-fluorobut-1-en-2-yl)cyclopent-3-ene-1,1-dicarboxylate
• 英文别名: Dimethyl 3-(3-fluorobut-1-en-2-yl)cyclopent-3-ene-1,1-dicarboxylate
• CAS: 1610622-46-2
• 化学式: C₁₃H₁₇FO₄
• 分子量: 256.274
• InChiKey: XXJXMCUHPXSVJM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  dimethyl 3-(3-fluorobut-1-en-2-yl)cyclopent-3-ene-1,1-dicarboxylate 在 2-碘酰基苯甲酸 作用下， 以 二甲基亚砜 为溶剂， 反应 40.0h， 生成 4,5-diethyl 2,2-dimethyl 7-(1-fluoroethyl)-1H-indene-2,2,4,5(3H)-tetracarboxylate
  参考文献：
  名称：

  A new synthesis of indanes with monofluorinated and gem-difluoroalkyl side chains

  摘要：

  The preparation of the new title compounds has been performed using a short and efficient strategy. Starting from appropriately substituted propargylic fluorides, intramolecular enyne metathesis reactions afford in excellent yields 1,3 dienes with the fluorinated side chains in internal position. Then, simple Diels-Alder-aromatisation sequences complete the synthesis of the target molecules. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2014.03.002
• 作为产物：
  描述：

  2-烯丙基-2-(2-丙炔-1-基)丙二酸二甲酯 在 RuCl2(1,3-dimesityl-imidazolidin-2-yl)(PCy3)(=CHPh) 、 正丁基锂 、 二乙胺基三氟化硫 作用下， 以 四氢呋喃 、 正己烷 、 二氯甲烷 为溶剂， 反应 25.25h， 生成 dimethyl 3-(3-fluorobut-1-en-2-yl)cyclopent-3-ene-1,1-dicarboxylate
  参考文献：
  名称：

  A new synthesis of indanes with monofluorinated and gem-difluoroalkyl side chains

  摘要：

  The preparation of the new title compounds has been performed using a short and efficient strategy. Starting from appropriately substituted propargylic fluorides, intramolecular enyne metathesis reactions afford in excellent yields 1,3 dienes with the fluorinated side chains in internal position. Then, simple Diels-Alder-aromatisation sequences complete the synthesis of the target molecules. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2014.03.002

文献信息

• A new synthesis of indanes with monofluorinated and gem-difluoroalkyl side chains
  作者：Pierre Bannwarth、Danielle Grée、Corinne Aubert、René Grée

  DOI：10.1016/j.jfluchem.2014.03.002

  日期：2014.6

  The preparation of the new title compounds has been performed using a short and efficient strategy. Starting from appropriately substituted propargylic fluorides, intramolecular enyne metathesis reactions afford in excellent yields 1,3 dienes with the fluorinated side chains in internal position. Then, simple Diels-Alder-aromatisation sequences complete the synthesis of the target molecules. (C) 2014 Elsevier B.V. All rights reserved.