2-(2-甲氧基苯基)-3-甲基-1,3-恶唑烷 | 67625-14-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 中文名称: 2-(2-甲氧基苯基)-3-甲基-1,3-恶唑烷
• 英文名称: 2-(o-Methoxyphenyl)-3-methyloxazolidine
• 英文别名: 2-(2-methoxyphenyl)-3-methyl-1,3-oxazolidine
• CAS: 67625-14-3
• 化学式: C₁₁H₁₅NO₂
• 分子量: 193.246
• InChiKey: GVXDSPLOAJPYFR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  21.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(2-甲氧基苯基)-3-甲基-1,3-恶唑烷 在 氢化钾 作用下， 以 四氢呋喃 为溶剂， 反应 24.0h， 生成 N-(2-羟乙基)-N-(2-甲氧基苄基)甲胺
  参考文献：
  名称：

  Reductive cleavage of N-substituted 2-aryl-1,3-oxazolidines: generation of .alpha.-amino-substituted carbanions

  摘要：

  The behavior of several N-substituted 2-aryl-1,3-oxazolidines has been investigated under conditions of electron transfer from alkali metals in aprotic solvents. The reduction led to the regioselective cleavage of the benzylic carbon-oxygen bond, with formation of the corresponding N-substituted benzylamino alcohols in good yields. Investigation of the mechanism of this reductive cleavage, with the aid of labeling experiments, showed the intermediate formation of alpha-tertiary amino-substituted carbanions.

  DOI：

  10.1021/jo00076a033
• 作为产物：
  描述：

  N-甲基-2-羟基乙胺 、 邻甲氧基苯甲醛 生成 2-(2-甲氧基苯基)-3-甲基-1,3-恶唑烷
  参考文献：
  名称：

  Robbe; Fernandez; Dubief, European Journal of Medicinal Chemistry, 1982, vol. 17, # 3, p. 235 - 243

  摘要：

  DOI：

文献信息

• Robbe; Fernandez; Dubief, European Journal of Medicinal Chemistry, 1982, vol. 17, # 3, p. 235 - 243
  作者：Robbe、Fernandez、Dubief、et al.

  DOI：——

  日期：——
• Reductive cleavage of N-substituted 2-aryl-1,3-oxazolidines: generation of .alpha.-amino-substituted carbanions
  作者：Ugo Azzena、Giovanni Melloni、Cristina Nigra

  DOI：10.1021/jo00076a033

  日期：1993.11

  The behavior of several N-substituted 2-aryl-1,3-oxazolidines has been investigated under conditions of electron transfer from alkali metals in aprotic solvents. The reduction led to the regioselective cleavage of the benzylic carbon-oxygen bond, with formation of the corresponding N-substituted benzylamino alcohols in good yields. Investigation of the mechanism of this reductive cleavage, with the aid of labeling experiments, showed the intermediate formation of alpha-tertiary amino-substituted carbanions.