1-cyclopropyl-2-ethoxybut-3-enyl isobutyrate | 934668-00-5

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 1-cyclopropyl-2-ethoxybut-3-enyl isobutyrate
• 英文别名: (1-Cyclopropyl-2-ethoxybut-3-enyl) 2-methylpropanoate
• CAS: 934668-00-5
• 化学式: C₁₃H₂₂O₃
• 分子量: 226.316
• InChiKey: XAJYWMXESRFAGO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  16
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-cyclopropyl-2-ethoxybut-3-enyl isobutyrate 在 Hoveyda-Grubbs catalyst second generation 、 lead(II) chloride 四甲基乙二胺 、 四氯化钛 、 锌 作用下， 以 四氢呋喃 、 甲苯 为溶剂， 生成 2-cyclopropyl-5-isoppropylfuran
  参考文献：
  名称：

  A Metathesis-Based Approach to the Synthesis of Furans

  摘要：

  The enol ether-olefin ring-closing metathesis reaction has been employed to generate 2,3-dihydrofurans that are equipped with a leaving group. These substrates are at the correct oxidation state to undergo an acid-catalyzed aromatization, and this strategy has been utilized to provide a mild and rapid route (four steps) to a range of novel 2,5-disubstituted furans.

  DOI：

  10.1021/ol062933r
• 作为产物：
  描述：

  乙基烯丙基醚 在 仲丁基锂 、 三乙胺 作用下， 以 四氢呋喃 、 正己烷 、 二氯甲烷 为溶剂， 反应 1.5h， 生成 1-cyclopropyl-2-ethoxybut-3-enyl isobutyrate
  参考文献：
  名称：

  A Metathesis-Based Approach to the Synthesis of Furans

  摘要：

  The enol ether-olefin ring-closing metathesis reaction has been employed to generate 2,3-dihydrofurans that are equipped with a leaving group. These substrates are at the correct oxidation state to undergo an acid-catalyzed aromatization, and this strategy has been utilized to provide a mild and rapid route (four steps) to a range of novel 2,5-disubstituted furans.

  DOI：

  10.1021/ol062933r

文献信息

• A Metathesis-Based Approach to the Synthesis of Furans
  作者：Timothy J. Donohoe、Lisa P. Fishlock、Adam R. Lacy、Panayiotis A. Procopiou

  DOI：10.1021/ol062933r

  日期：2007.3.1

  The enol ether-olefin ring-closing metathesis reaction has been employed to generate 2,3-dihydrofurans that are equipped with a leaving group. These substrates are at the correct oxidation state to undergo an acid-catalyzed aromatization, and this strategy has been utilized to provide a mild and rapid route (four steps) to a range of novel 2,5-disubstituted furans.