| 73007-70-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 氮杂环丁烷
• CAS: 73007-70-2
• 化学式: C₄H₇NO
• 分子量: 87.1063
• InChiKey: HNJBEVLQSNELDL-ZQBYOMGUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.1
• 重原子数：
  6.0
• 可旋转键数：
  0.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  29.1
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为产物：
  描述：

  2-吡咯烷酮 在 重氧水 作用下， 生成
  参考文献：
  名称：

  Structural dependence of oxygen-18 isotope shifts in carbon-13 NMR spectra

  摘要：

  DOI：

  10.1021/ja00521a063

文献信息

• Oxidant-Free Conversion of Cyclic Amines to Lactams and H₂ Using Water As the Oxygen Atom Source
  作者：Julia R. Khusnutdinova、Yehoshoa Ben-David、David Milstein

  DOI：10.1021/ja500026m

  日期：2014.2.26

  Direct conversion of cyclic amines to lactams utilizing water as the only reagent is catalyzed by pincer complex 2. In contrast to previously known methods of amine-to-amide conversion, this reaction occurs in the absence of oxidants and is accompanied by liberation of H-2, with water serving as a source of oxygen atom. Formation of a cyclic hemiaminal intermediate plays a key role in enabling such reactivity. This represents an unprecedented, conceptually new type of amide formation reaction directly from amines and water under oxidant-free conditions.