2-ethyl-4-methyl-5-phenyl-4,5-dihydro-oxazole | 794534-21-7

• 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: 2-ethyl-4-methyl-5-phenyl-4,5-dihydro-oxazole
• 英文别名: (4S,5S)-2-ethyl-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazole
• CAS: 794534-21-7
• 化学式: C₁₂H₁₅NO
• 分子量: 189.257
• InChiKey: BRNLAXPOVNXAIA-JOYOIKCWSA-N

物化性质

• 沸点：
  276.3±29.0 °C(Predicted)
• 密度：
  1.06±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  21.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-ethyl-4-methyl-5-phenyl-4,5-dihydro-oxazole 、 苯 在 三氟甲磺酸 作用下， 以97%的产率得到N-[(2S)-1,1-diphenylpropan-2-yl]propanamide
  参考文献：
  名称：

  Superacid catalyzed ring-opening reactions involving 2-oxazolines and the role of superelectrophilic intermediates

  摘要：

  A variety of 2-oxazolines are found to react with arenes in superacidic triflic acid, CF3SO3H. It is proposed that the 2-oxazolines are protonated twice in triflic acid and the resulting intermediates undergo ring-opening reactions to produce reactive, dicationic species. These superelectrophiles are capable of reacting with benzene and o-dichlorobenzene in high yields by Friedel-Crafts type reactions. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.08.109

文献信息

• Superacid catalyzed ring-opening reactions involving 2-oxazolines and the role of superelectrophilic intermediates
  作者：Douglas A. Klumpp、Rendy Rendy、Aaron McElrea

  DOI：10.1016/j.tetlet.2004.08.109

  日期：2004.10

  A variety of 2-oxazolines are found to react with arenes in superacidic triflic acid, CF3SO3H. It is proposed that the 2-oxazolines are protonated twice in triflic acid and the resulting intermediates undergo ring-opening reactions to produce reactive, dicationic species. These superelectrophiles are capable of reacting with benzene and o-dichlorobenzene in high yields by Friedel-Crafts type reactions. (C) 2004 Elsevier Ltd. All rights reserved.