N-ethyl-N-(3-oxo-3-phenylpropyl)acetamide | 1313493-76-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N-ethyl-N-(3-oxo-3-phenylpropyl)acetamide
• CAS: 1313493-76-3
• 化学式: C₁₃H₁₇NO₂
• 分子量: 219.283
• InChiKey: RAZMJUUFILJHMZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  37.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  N-Aethyl-β-aminopropiophenon 、 乙酸酐 生成 N-ethyl-N-(3-oxo-3-phenylpropyl)acetamide
  参考文献：
  名称：

  Superelectrophilic chemistry of amino-nitriles and related substrates

  摘要：

  The superacid-promoted Houben/Hoesch reactions of amino-nitriles and related compounds have been studied. The nitriles form dicationic electrophiles and react with benzene in fair to good yields (12-95%). The intermediate iminium ions may also be reduced to the benzylic amines by NaBH4 or H-2. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.04.038

文献信息

• Superelectrophilic chemistry of amino-nitriles and related substrates
  作者：Erum K. Raja、Douglas A. Klumpp

  DOI：10.1016/j.tet.2011.04.038

  日期：2011.6

  The superacid-promoted Houben/Hoesch reactions of amino-nitriles and related compounds have been studied. The nitriles form dicationic electrophiles and react with benzene in fair to good yields (12-95%). The intermediate iminium ions may also be reduced to the benzylic amines by NaBH4 or H-2. (C) 2011 Elsevier Ltd. All rights reserved.