1-(4-Methylcyclohexen-1-yl)heptan-1-one | 1219688-26-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(4-Methylcyclohexen-1-yl)heptan-1-one
• 英文别名: 1-(4-methylcyclohexen-1-yl)heptan-1-one
• CAS: 1219688-26-2
• 化学式: C₁₄H₂₄O
• 分子量: 208.344
• InChiKey: IAUUBMSJVDMBCI-UHFFFAOYSA-N

物化性质

• 沸点：
  110-112 °C(Press: 3 Torr)
• 密度：
  1.4662 g/cm3

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.79
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-(4-Methylcyclohexen-1-yl)heptan-1-one 在 氢溴酸 、 双氧水 作用下， 以 水 为溶剂， 反应 10.0h， 生成 1,2-dihydroxy-4-methyl-1-heptanoylcyclohexane
  参考文献：
  名称：

  Study of induced hypohalogenation of 1-alkyl(4-methylcyclohex-1-enyl)alkanones, and chemical transformations of the obtained compounds

  摘要：

  Induced hydroxyhalogenation of alkyl cyclohexenyl ketones in the systems [MHlg-HX or HHlg]-H2O2 or (NaClO) was performed and the optimal conditions of this reaction were elucidated. It is established that in the system in situ is induced a hypohaloid acid HClO or HBrO is produced that then enters into electrophilic addition at the ring double bond affording hydroxyhalo derivatives of the cycloaliphatic ketones. The alkyl cyclohexenyl ketone chloro(bromo)hydrines and the oxiranes obtained from them are very reactive compounds and can be used as initial compounds for the synthesis of many individual organic compounds

  DOI：

  10.1134/s1070363209080180
• 作为产物：
  描述：

  4-甲基-1-环己烯 、 庚酰氯 在 SnCl₄ on a solid carrier HNa-modernit 作用下， 以35.8%的产率得到1-(4-Methylcyclohexen-1-yl)heptan-1-one
  参考文献：
  名称：

  Study of induced hypohalogenation of 1-alkyl(4-methylcyclohex-1-enyl)alkanones, and chemical transformations of the obtained compounds

  摘要：

  Induced hydroxyhalogenation of alkyl cyclohexenyl ketones in the systems [MHlg-HX or HHlg]-H2O2 or (NaClO) was performed and the optimal conditions of this reaction were elucidated. It is established that in the system in situ is induced a hypohaloid acid HClO or HBrO is produced that then enters into electrophilic addition at the ring double bond affording hydroxyhalo derivatives of the cycloaliphatic ketones. The alkyl cyclohexenyl ketone chloro(bromo)hydrines and the oxiranes obtained from them are very reactive compounds and can be used as initial compounds for the synthesis of many individual organic compounds

  DOI：

  10.1134/s1070363209080180

文献信息

• Study of induced hypohalogenation of 1-alkyl(4-methylcyclohex-1-enyl)alkanones, and chemical transformations of the obtained compounds
  作者：O. A. Sadygov

  DOI：10.1134/s1070363209080180

  日期：2009.8

  Induced hydroxyhalogenation of alkyl cyclohexenyl ketones in the systems [MHlg-HX or HHlg]-H2O2 or (NaClO) was performed and the optimal conditions of this reaction were elucidated. It is established that in the system in situ is induced a hypohaloid acid HClO or HBrO is produced that then enters into electrophilic addition at the ring double bond affording hydroxyhalo derivatives of the cycloaliphatic ketones. The alkyl cyclohexenyl ketone chloro(bromo)hydrines and the oxiranes obtained from them are very reactive compounds and can be used as initial compounds for the synthesis of many individual organic compounds