2-Hydroxy-2-methylbutylacetat | 42125-49-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-Hydroxy-2-methylbutylacetat
• 英文别名: acetic acid-(2-hydroxy-2-methyl-butyl ester)；Essigsaeure-(2-hydroxy-2-methyl-butylester)；(2-Hydroxy-2-methylbutyl) acetate；(2-hydroxy-2-methylbutyl) acetate
• CAS: 42125-49-5
• 化学式: C₇H₁₄O₃
• 分子量: 146.186
• InChiKey: BTIXKTULYUKLCG-UHFFFAOYSA-N

物化性质

• 沸点：
  221.0±13.0 °C(Predicted)
• 密度：
  1.007±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  10
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-甲基丁基乙酸酯 在 perfluoro-cis-2-n-butyl-3-n-propyloxaziridine 作用下， 以 一氟三氯甲烷 为溶剂， 反应 24.0h， 生成 2-Hydroxy-2-methylbutylacetat 、 2-丁酮,4-(乙酰氧基)-3-甲基-
  参考文献：
  名称：

  Highly Enantiospecific Oxyfunctionalization of Nonactivated Hydrocarbon Sites by Perfluoro-cis-2-n-butyl-3-n-propyloxaziridine

  摘要：

  [GRAPHICS]Nonactivated hydrocarbon sites of enantiopure compounds are oxyfunctionalized enantiospecifically by perfluoro-cis-2-n-butyl-3-n-propyloxaziridine under remarkably mild reaction conditions. The reaction occurs with retention of configuration at the oxidized stereogenic center, and the enantiospecificity is highly independent from both the carbon framework of the substrate and the presence of functional groups.

  DOI：

  10.1021/ol990594e

文献信息

• Kling, Annales de Chimie (Cachan, France), 1905, vol. <8>5, p. 494
  作者：Kling

  DOI：——

  日期：——
• Kling, Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1903, vol. 137, p. 758
  作者：Kling

  DOI：——

  日期：——
• Highly Enantiospecific Oxyfunctionalization of Nonactivated Hydrocarbon Sites by Perfluoro-<i>cis</i>-2-<i>n</i>-butyl-3-<i>n</i>-propyloxaziridine
  作者：Alberto Arnone、Stefania Foletto、Pierangelo Metrangolo、Massimo Pregnolato、Giuseppe Resnati

  DOI：10.1021/ol990594e

  日期：1999.7.1

  [GRAPHICS]Nonactivated hydrocarbon sites of enantiopure compounds are oxyfunctionalized enantiospecifically by perfluoro-cis-2-n-butyl-3-n-propyloxaziridine under remarkably mild reaction conditions. The reaction occurs with retention of configuration at the oxidized stereogenic center, and the enantiospecificity is highly independent from both the carbon framework of the substrate and the presence of functional groups.