N-(3-Nitro-phenyl)-N-oxiranylmethyl-benzenesulfonamide | 332907-66-1

• 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: N-(3-Nitro-phenyl)-N-oxiranylmethyl-benzenesulfonamide
• 英文别名: N-(3-nitrophenyl)-N-(oxiran-2-ylmethyl)benzenesulfonamide
• CAS: 332907-66-1
• 化学式: C₁₅H₁₄N₂O₅S
• 分子量: 334.353
• InChiKey: OMTUTHAJWNGTPL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  104
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N-(3-Nitro-phenyl)-N-oxiranylmethyl-benzenesulfonamide 、 endo-5-aminomethylbicyclo[2.2.1]hept-2-ene 以 异丙醇 为溶剂， 以55%的产率得到N-{3-[(bicyclo[2.2.1]hept-5-en-endo-2-ylmethyl)amino]-2-hydroxypropyl}-N-(3-nitrophenyl)benzenesulfonamide
  参考文献：
  名称：

  Reaction of N-(2,3-epoxypropyl)arenesulfonamides with (bicyclo[2.2.1]hept-5-en-endo-2-yl)methanamine

  摘要：

  Reactions of bicyclo[2.2.1]hept-5-en-endo-2-ylmethanamine with N-(2,3-epoxypropyl)arenesulfonamides gave amino alcohols having a norbornene fragment and sulfonamide group. The major products were formed via opening of the oxirane ring according to the Krasuskii rule. The product structure was determined by (1)H and (13)C NMR spectroscopy using DEPT and two-dimensional COSY, NOESY, HMQC, and HMBC techniques.

  DOI：

  10.1134/s107042800904006x

文献信息

• Reaction of N-(2,3-epoxypropyl)arenesulfonamides with (bicyclo[2.2.1]hept-5-en-endo-2-yl)methanamine
  作者：L. I. Kas’yan、S. A. Prid’ma、A. V. Turov、V. A. Pal’chikov、A. O. Kas’yan、L. D. Karat

  DOI：10.1134/s107042800904006x

  日期：2009.4

  Reactions of bicyclo[2.2.1]hept-5-en-endo-2-ylmethanamine with N-(2,3-epoxypropyl)arenesulfonamides gave amino alcohols having a norbornene fragment and sulfonamide group. The major products were formed via opening of the oxirane ring according to the Krasuskii rule. The product structure was determined by (1)H and (13)C NMR spectroscopy using DEPT and two-dimensional COSY, NOESY, HMQC, and HMBC techniques.