1-methoxy-4-benzoylbutyl hydroperoxide | 76355-52-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-methoxy-4-benzoylbutyl hydroperoxide
• 英文别名: 5-Hydroperoxy-5-methoxy-1-phenylpentan-1-one
• CAS: 76355-52-7
• 化学式: C₁₂H₁₆O₄
• 分子量: 224.257
• InChiKey: GBUVFRXXYNQQBK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  16
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  55.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1-phenyl-6,7,8-trioxa-bicyclo<3.2.1>octane 在 氯磺酸 、 氯化锑(V) 、 双氧水 作用下， 以 甲醇 为溶剂， 反应 6.0h， 生成 1-methoxy-4-benzoylbutyl hydroperoxide
  参考文献：
  名称：

  Miura, Masahiro; Nojima, Masatomo; Kusabayashi, Shigekazu, Journal of the Chemical Society. Perkin transactions I, 1980, p. 2909 - 2913

  摘要：

  DOI：

文献信息

• Ozonolyses of 1-Alkyl-Substituted 3-Methylindenes. Remarkable Effects of the Substituent Steric Bulk and the Stereochemistry of the Carbonyl Oxide Intermediates on the Efficiency of Ozonide Formation
  作者：Shin-ichi Kawamura、Rika Takeuchi、Araki Masuyama、Masatomo Nojima、Kevin J. McCullough

  DOI：10.1021/jo980542n

  日期：1998.8.1

  Ozonolyses of 3-methyl- and 3-isopropyl-1-methylindenes (1a,b) in ether gave mainly the corresponding oligomers 3a,b, while in the case of 3-phenyl- and 3-tert-butyl-1-methylindenes (1c,d), the corresponding exo-endo mixtures of ozonides 2c,d were obtained in good yield, the exo isomer being the major one. The ozonolyses of two stereoisomeric keto vinyl ethers, (E)-16 and (Z)-16, demonstrated that the stereochemistry of the derived carbonyl oxide 5c exerts a remarkable influence on the course of the reaction. Particularly interesting is the fact that syn-5c having a proper geometry for the concerted cycloaddition provided ozonide 2c in high yield even in the presence of trifluoroacetophenone. The high degree of similarity in the nature and distribution of the products from the ozonolyses of keto olefin (E)-16 and 1-methyl-3-phenylindene (1c) would be consistent with their respective reactions proceeding predominantly through a common carbonyl oxide intermediate syn-5c.
• MIURA MASAHIRO; NOJIMA MASATOMO; KUSABAYASHI SHIGEKAZU, J. CHEM. SOC. PERKIN TRANS., PART 1, 1980, NO 12, 2909-2913
  作者：MIURA MASAHIRO、 NOJIMA MASATOMO、 KUSABAYASHI SHIGEKAZU

  DOI：——

  日期：——
• Miura, Masahiro; Nojima, Masatomo; Kusabayashi, Shigekazu, Journal of the Chemical Society. Perkin transactions I, 1980, p. 2909 - 2913
  作者：Miura, Masahiro、Nojima, Masatomo、Kusabayashi, Shigekazu

  DOI：——

  日期：——