1-(3-butenoxy)cyclohexyl hydroperoxide | 194297-37-5

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机氢过氧化物
• 英文名称: 1-(3-butenoxy)cyclohexyl hydroperoxide
• 英文别名: 1-But-3-enoxy-1-hydroperoxycyclohexane
• CAS: 194297-37-5
• 化学式: C₁₀H₁₈O₃
• 分子量: 186.251
• InChiKey: ZVHVOCUTZULLTM-UHFFFAOYSA-N

物化性质

• 沸点：
  281.8±29.0 °C(Predicted)
• 密度：
  1.02±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(3-butenoxy)cyclohexyl hydroperoxide 在 乙酸酐 、 臭氧 、 三乙胺 作用下， 生成 2-oxo-7,8,12-trioxaspiro[5.6]dodecane
  参考文献：
  名称：

  Synthesis of Hydroxy(or Hydroperoxy)-Substituted 1,2,4-Trioxacycloalkanes by the Ozonolysis of Unsaturated Hydroperoxy Acetals

  摘要：

  Ozonolyses of unsaturated hydroperoxy acetals 4a-k gave in each case the mixtures of products containing the corresponding trioxanes 8a-f and 12e,f, trioxepanes 12g-i, trioxocane 12j, and trioxonane 12k. By choosing the proper conditions of the ozonolysis, the desired cyclic peroxide was selectively obtained in moderate to good yield. Alternatively, acid-catalyzed cyclization of the methanol-derived ozonolysis products 13h and 13j provided the corresponding trioxepane 12h and trioxocane 12j, respectively.

  DOI：

  10.1021/jo970555l
• 作为产物：
  描述：

  3-丁烯-1-醇 、 (甲氧基亚甲基)环己烷 在 臭氧 作用下， 以 二氯甲烷 为溶剂， 以67%的产率得到1-(3-butenoxy)cyclohexyl hydroperoxide
  参考文献：
  名称：

  Synthesis of Hydroxy(or Hydroperoxy)-Substituted 1,2,4-Trioxacycloalkanes by the Ozonolysis of Unsaturated Hydroperoxy Acetals

  摘要：

  Ozonolyses of unsaturated hydroperoxy acetals 4a-k gave in each case the mixtures of products containing the corresponding trioxanes 8a-f and 12e,f, trioxepanes 12g-i, trioxocane 12j, and trioxonane 12k. By choosing the proper conditions of the ozonolysis, the desired cyclic peroxide was selectively obtained in moderate to good yield. Alternatively, acid-catalyzed cyclization of the methanol-derived ozonolysis products 13h and 13j provided the corresponding trioxepane 12h and trioxocane 12j, respectively.

  DOI：

  10.1021/jo970555l

文献信息

• Synthesis of Hydroxy(or Hydroperoxy)-Substituted 1,2,4-Trioxacycloalkanes by the Ozonolysis of Unsaturated Hydroperoxy Acetals
  作者：Yoshihiro Ushigoe、Yuko Torao、Araki Masuyama、Masatomo Nojima

  DOI：10.1021/jo970555l

  日期：1997.7.1

  Ozonolyses of unsaturated hydroperoxy acetals 4a-k gave in each case the mixtures of products containing the corresponding trioxanes 8a-f and 12e,f, trioxepanes 12g-i, trioxocane 12j, and trioxonane 12k. By choosing the proper conditions of the ozonolysis, the desired cyclic peroxide was selectively obtained in moderate to good yield. Alternatively, acid-catalyzed cyclization of the methanol-derived ozonolysis products 13h and 13j provided the corresponding trioxepane 12h and trioxocane 12j, respectively.