4-(2-But-3-ynoxypropan-2-yl)-1-methylcyclohexene | 1192307-76-8

• 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: 4-(2-But-3-ynoxypropan-2-yl)-1-methylcyclohexene
• 英文别名: 4-(2-but-3-ynoxypropan-2-yl)-1-methylcyclohexene
• CAS: 1192307-76-8
• 化学式: C₁₄H₂₂O
• 分子量: 206.328
• InChiKey: RYWUQYMLYAUGHK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  3-丁炔-1-醇 、 Pinene 在 iron(III) chloride 作用下， 以 二氯甲烷 为溶剂， 反应 1.5h， 以70%的产率得到4-(2-But-3-ynoxypropan-2-yl)-1-methylcyclohexene
  参考文献：
  名称：

  FeCl3-catalyzed functionalization of monoterpenes via hydroalkylation of unactivated alkenes

  摘要：

  Monoterpenes such as alpha-pinene, beta-pinene, limonene and isolimonene undergo smooth hydroalkoxylation in the presence of 20 mol % of FeCl3 under mild reaction conditions to produce a wide range of the corresponding ethers in excellent yields and with high selectivity. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.07.057

文献信息

• FeCl3-catalyzed functionalization of monoterpenes via hydroalkylation of unactivated alkenes
  作者：J.S. Yadav、B.V. Subba Reddy、G. Narasimhulu、K.V. Purnima

  DOI：10.1016/j.tetlet.2009.07.057

  日期：2009.10

  Monoterpenes such as alpha-pinene, beta-pinene, limonene and isolimonene undergo smooth hydroalkoxylation in the presence of 20 mol % of FeCl3 under mild reaction conditions to produce a wide range of the corresponding ethers in excellent yields and with high selectivity. (C) 2009 Elsevier Ltd. All rights reserved.