1,2-dimethylpropyl 3-chlorobenzoate | 97989-34-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1,2-dimethylpropyl 3-chlorobenzoate
• 英文别名: 3-Methylbutan-2-yl 3-chlorobenzoate
• CAS: 97989-34-9
• 化学式: C₁₂H₁₅ClO₂
• 分子量: 226.703
• InChiKey: UJFYEUKAHUQXLE-UHFFFAOYSA-N

物化性质

• 保留指数：
  1512;1521;1527;1514;1523;1531

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  3-甲基-2-丁醇 、 3-chlorobenzaldehyde oxime 在 2-硝基苯硒酸 、 双氧水 作用下， 反应 4.0h， 以47%的产率得到1,2-dimethylpropyl 3-chlorobenzoate
  参考文献：
  名称：

  Oxidative Conversion of Aldoximes into Carboxylic Acid Esters

  摘要：

  Aromatic and aliphatic aldoximes or their O-methyl ethers can be efficiently converted into the corresponding carboxylic acid esters by treatment with an alcoholic solution of 30% hydrogen peroxide in the Presence of catalytic amounts of 2-nitrobenzeneseleninic acid. Primary alcohols give excellent to good yields, secondary ones - good to moderate, but with tertiary alcohols no esterification is obserwed.

  DOI：

  10.1080/00397919208021316

文献信息

• Oxidative Conversion of Aldoximes into Carboxylic Acid Esters
  作者：Said、Skarzewski、Mlochowski

  DOI：10.1080/00397919208021316

  日期：1992.7

  Aromatic and aliphatic aldoximes or their O-methyl ethers can be efficiently converted into the corresponding carboxylic acid esters by treatment with an alcoholic solution of 30% hydrogen peroxide in the Presence of catalytic amounts of 2-nitrobenzeneseleninic acid. Primary alcohols give excellent to good yields, secondary ones - good to moderate, but with tertiary alcohols no esterification is obserwed.