ethyl 2-(1-allylcyclopropyl)acetate | 1064245-86-8

• 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: ethyl 2-(1-allylcyclopropyl)acetate
• 英文别名: ethyl 2-(1-prop-2-enylcyclopropyl)acetate
• CAS: 1064245-86-8
• 化学式: C₁₀H₁₆O₂
• 分子量: 168.236
• InChiKey: JPXVEPJTDRSTGQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  12
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  ethyl 2-(1-allylcyclopropyl)acetate 以 四氢呋喃 为溶剂， 以87%的产率得到2-(1-allylcyclopropyl)ethanol
  参考文献：
  名称：

  Hepatitis C Virus Inhibitors

  摘要：

  揭示了具有一般式的丙型肝炎病毒抑制剂。还揭示了包含这些化合物的组合物以及使用这些化合物抑制HCV的方法。

  公开号：

  US20100080770A1
• 作为产物：
  描述：

  triallylindium 、 环亚丙基乙酸乙酯 以 四氢呋喃 、 水 为溶剂， 反应 5.0h， 以65%的产率得到ethyl 2-(1-allylcyclopropyl)acetate
  参考文献：
  名称：

  Allylation of methylenecyclopropanes with allylindium reagents

  摘要：

  Methylenecyclopropanes carrying a hydroxymethyl group at the ring underwent stereoselective allylindation with allylindium sesquiiodide to afford the allylated products, in which the allyl group was delivered at the external sp(2) carbon via cyclopropylindium intermediates. The reaction of ethyl 2-cyclopropylideneacetate and triallylindium afforded the 1,4-adduct along with dimeric products. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.07.009

文献信息

• HEPATITIS C VIRUS INHIBITORS
  申请人：Bristol-Myers Squibb Company

  公开号：EP2331552A1

  公开（公告）日：2011-06-15
• [EN] HEPATITIS C VIRUS INHIBITORS<br/>[FR] INHIBITEURS DU VIRUS DE L'HÉPATITE C
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2010036551A1

  公开（公告）日：2010-04-01

  Hepatitis C virus inhibitors having the general formula are disclosed. Compositions comprising the compounds and methods for using the compounds to inhibit HCV are also disclosed.
• Allylation of methylenecyclopropanes with allylindium reagents
  作者：Tsunehisa Hirashita、Yusuke Daikoku、Hitoshi Osaki、Mamiko Ogura、Shuki Araki

  DOI：10.1016/j.tetlet.2008.07.009

  日期：2008.9

  Methylenecyclopropanes carrying a hydroxymethyl group at the ring underwent stereoselective allylindation with allylindium sesquiiodide to afford the allylated products, in which the allyl group was delivered at the external sp(2) carbon via cyclopropylindium intermediates. The reaction of ethyl 2-cyclopropylideneacetate and triallylindium afforded the 1,4-adduct along with dimeric products. (c) 2008 Elsevier Ltd. All rights reserved.
• Hepatitis C Virus Inhibitors
  申请人：Hiebert Sheldon

  公开号：US20100080770A1

  公开（公告）日：2010-04-01

  Hepatitis C virus inhibitors having the general formula are disclosed. Compositions comprising the compounds and methods for using the compounds to inhibit HCV are also disclosed.

  揭示了具有一般式的丙型肝炎病毒抑制剂。还揭示了包含这些化合物的组合物以及使用这些化合物抑制HCV的方法。