tert-butyl N-(benzenesulfonyl)-N-acetyloxy-carbamate | 1222783-18-7

• 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: tert-butyl N-(benzenesulfonyl)-N-acetyloxy-carbamate
• 英文别名: [Benzenesulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] acetate
• CAS: 1222783-18-7
• 化学式: C₁₃H₁₇NO₆S
• 分子量: 315.347
• InChiKey: GYRJLTWCZFAIOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  98.4
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  tert-butyl N-(benzenesulfonyl)-N-acetyloxy-carbamate 在 三乙胺 、 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 0.08h， 生成 N-benzenesulfonyl-N-acetyloxy-acetamide
  参考文献：
  名称：

  Optimization of HNO Production from N,O-bis-Acylated Hydroxylamine Derivatives

  摘要：

  A wide range of N,O-bis-acylated hydroxylamine derivatives with chloro or arenesulfonyl leaving groups, and a related set of N-hydroxy-N-acylsulfonamides, have been synthesized and evaluated for nitroxyl (HNO) production. Mechanistic studies have revealed that the observed aqueous chemistry is more complicated than originally anticipated, and have been used to develop a new series of efficient HNO precursors (4u-4x, 7c-7d) with tunable half-lives.

  DOI：

  10.1021/ol203016c

文献信息

• Optimization of HNO Production from <i>N</i>,<i>O</i>-<i>bis</i>-Acylated Hydroxylamine Derivatives
  作者：Art D. Sutton、Morgan Williamson、Hilary Weismiller、John P. Toscano

  DOI：10.1021/ol203016c

  日期：2012.1.20

  A wide range of N,O-bis-acylated hydroxylamine derivatives with chloro or arenesulfonyl leaving groups, and a related set of N-hydroxy-N-acylsulfonamides, have been synthesized and evaluated for nitroxyl (HNO) production. Mechanistic studies have revealed that the observed aqueous chemistry is more complicated than originally anticipated, and have been used to develop a new series of efficient HNO precursors (4u-4x, 7c-7d) with tunable half-lives.