2-甲基-2-(6-甲基庚-6-烯基)-1,3-二氧戊环 | 40632-70-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 2-甲基-2-(6-甲基庚-6-烯基)-1,3-二氧戊环
• 英文名称: 2-methyl-2-(6-methyl-hept-6-enyl)-[1,3]dioxolane
• 英文别名: 2-Methyl-2-(6-methylhept-6-enyl)-1,3-dioxolane
• CAS: 40632-70-0
• 化学式: C₁₂H₂₂O₂
• 分子量: 198.305
• InChiKey: DEFCHNJPYHQGCT-UHFFFAOYSA-N

物化性质

• 沸点：
  246.4±15.0 °C(Predicted)
• 密度：
  0.898±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2932999099

反应信息

• 作为反应物：
  描述：

  2-甲基-2-(6-甲基庚-6-烯基)-1,3-二氧戊环 在 盐酸 、 六甲基磷酰三胺 、 samarium diiodide 、 叔丁醇 作用下， 以 四氢呋喃 为溶剂， 生成 1,3t-Dimethylcyclooctan-1r-ol
  参考文献：
  名称：

  Synthesis of Substituted Cyclooctanols by a Samarium(II) Iodide Promoted 8-Endo Radical Cyclization Process

  摘要：

  Samarium(II) iodide (SmI2) has been employed to promote an efficient 8-endo radical cyclization reaction of a variety of substituted olefinic ketones. Various substituted monocyclic, fused bicyclic, and bridged bicyclic cyclooctanols have been synthesized in fair to excellent yield via this protocol. In addition to delineating the synthetic potential of this reaction, experiments have been conducted to determine the source of reduced, noncyclized byproducts present in this and related SmI2-mediated reactions performed under protic conditions.

  DOI：

  10.1021/jo00090a041
• 作为产物：
  描述：

  2-(5-Chlor-pentyl)-2-methyl-1,3-dioxolan 在 正丁基锂 、 sodium iodide 作用下， 以 四氢呋喃 、 正己烷 、 丙酮 为溶剂， 反应 6.0h， 生成 2-甲基-2-(6-甲基庚-6-烯基)-1,3-二氧戊环
  参考文献：
  名称：

  Synthesis of Substituted Cyclooctanols by a Samarium(II) Iodide Promoted 8-Endo Radical Cyclization Process

  摘要：

  Samarium(II) iodide (SmI2) has been employed to promote an efficient 8-endo radical cyclization reaction of a variety of substituted olefinic ketones. Various substituted monocyclic, fused bicyclic, and bridged bicyclic cyclooctanols have been synthesized in fair to excellent yield via this protocol. In addition to delineating the synthetic potential of this reaction, experiments have been conducted to determine the source of reduced, noncyclized byproducts present in this and related SmI2-mediated reactions performed under protic conditions.

  DOI：

  10.1021/jo00090a041

文献信息

• Synthesis of Substituted Cyclooctanols by a Samarium(II) Iodide Promoted 8-Endo Radical Cyclization Process
  作者：Gary A. Molander、Jeffrey A. McKie

  DOI：10.1021/jo00090a041

  日期：1994.6

  Samarium(II) iodide (SmI2) has been employed to promote an efficient 8-endo radical cyclization reaction of a variety of substituted olefinic ketones. Various substituted monocyclic, fused bicyclic, and bridged bicyclic cyclooctanols have been synthesized in fair to excellent yield via this protocol. In addition to delineating the synthetic potential of this reaction, experiments have been conducted to determine the source of reduced, noncyclized byproducts present in this and related SmI2-mediated reactions performed under protic conditions.