(Z)-diethylamino-(4-methylphenyl)sulfonyloxyimino-oxidoazanium | 500127-97-9

• 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: (Z)-diethylamino-(4-methylphenyl)sulfonyloxyimino-oxidoazanium
• CAS: 500127-97-9
• 化学式: C₁₁H₁₇N₃O₄S
• 分子量: 287.34
• InChiKey: KBHASZBYABQKCN-OWBHPGMISA-N

物化性质

• 沸点：
  400.9±38.0 °C(Predicted)
• 密度：
  1.25±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  19
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  96.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  (Z)-diethylamino-(4-methylphenyl)sulfonyloxyimino-oxidoazanium 在 ethyl thiolate 作用下， 以 氘代二甲亚砜 为溶剂， 生成 p-toluenesulfonic acid
  参考文献：
  名称：

  Preparation and Reactivity of O²-Sulfonated Diazeniumdiolates

  摘要：

  We report the facile preparation of O-2-sulfonated diazeniumdiolates and mechanistic investigation of their reactions with representative nucleophiles. This new class of compounds extends the range of O-2-substituted diazeniumdiolates available for potential applications in research and medicine.

  DOI：

  10.1021/jo026656n
• 作为产物：
  描述：

  对甲苯磺酰氯 、 1-(N,N-diethylamino)diazen-1-ium-1,2-diolate 生成 (Z)-diethylamino-(4-methylphenyl)sulfonyloxyimino-oxidoazanium
  参考文献：
  名称：

  Preparation and Reactivity of O²-Sulfonated Diazeniumdiolates

  摘要：

  We report the facile preparation of O-2-sulfonated diazeniumdiolates and mechanistic investigation of their reactions with representative nucleophiles. This new class of compounds extends the range of O-2-substituted diazeniumdiolates available for potential applications in research and medicine.

  DOI：

  10.1021/jo026656n

文献信息

• Preparation and Reactivity of <i>O</i>²-Sulfonated Diazeniumdiolates
  作者：Raechelle A. D'Sa、Yuhong Wang、Patrick H. Ruane、Brett M. Showalter、Joseph E. Saavedra、Keith M. Davies、Michael L. Citro、Melissa N. Booth、Larry K. Keefer、John P. Toscano

  DOI：10.1021/jo026656n

  日期：2003.1.1

  We report the facile preparation of O-2-sulfonated diazeniumdiolates and mechanistic investigation of their reactions with representative nucleophiles. This new class of compounds extends the range of O-2-substituted diazeniumdiolates available for potential applications in research and medicine.