Acetamide, N-methyl-, sodium salt | 51206-97-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Acetamide, N-methyl-, sodium salt
• 英文别名: sodium;N-methylacetamide
• CAS: 51206-97-4
• 化学式: C₃H₇NO*Na
• 分子量: 96.0844
• InChiKey: KXFIQNJUJQCJLY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3.24
• 重原子数：
  6
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  29.1
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2924199090

反应信息

• 作为反应物：
  描述：

  Acetamide, N-methyl-, sodium salt 以 甲醇 为溶剂， 生成 N-甲基乙酰胺
  参考文献：
  名称：

  Reaction Enthalpies for M⁺L = M⁺ + L, Where M⁺ = Na⁺ and K⁺ and L = Acetamide, N-Methylacetamide, N,N-Dimethylacetamide, Glycine, and Glycylglycine, from Determinations of the Collision-Induced Dissociation Thresholds

  摘要：

  With electrospray (ES), ions present in solution can be transferred to the gas phase. The method provides unique opportunities for studies of hitherto inaccessible ions. Collision-induced dissociation threshold measurements of gas phase ions produced by ES are described. The thresholds for the reactions M(+)L = M(+) + L, where M(+) is Na+ or K+ and L is acetone, dimethyl sulfoxide, acetamide, N-methylacetamide, N,N-dimethylacetamide, glycine, glycinamide, succinamide, and glycylglycine, were determined. Enthalpy changes for the reaction were derived from these data.

  DOI：

  10.1021/jp9608382