2,4,6-tribromo(tert-butyl-NNO-azoxy)benzene | 168297-38-9

• 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: 2,4,6-tribromo(tert-butyl-NNO-azoxy)benzene
• 英文别名: 2,4,6-Tribromo(t-butyl-nno-azoxy)benzene；tert-butylimino-oxido-(2,4,6-tribromophenyl)azanium
• CAS: 168297-38-9
• 化学式: C₁₀H₁₁Br₃N₂O
• 分子量: 414.922
• InChiKey: XCNWXURTUJTFKO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  41.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2,4,6-tribromo(tert-butyl-NNO-azoxy)benzene 在 氨 作用下， 以 乙醇 为溶剂， 反应 6.0h， 以55%的产率得到3,5-dibromo-4-(tert-butyl-NNO-azoxy)aniline
  参考文献：
  名称：

  Synthesis of brominated 2-(tert-butyl-NNO-azoxy)anilmes

  摘要：

  2-(tert-Butyl-NNO-azoxy)aniline was prepared by selective reduction of 2-(tert-butyl-NNO-azoxy)nitrobenzene. Its bromination yielded the corresponding para-bromo- and ortho,para-dibromoanilines (3a,b). meta-Bromoanilines (6a,b) were synthesized by selective replacement of the ortho-bromine atoms in ortho,para-bromo(tert-butylazoxy)benzene (5a,b) by ammonia in toluene under pressure.

  DOI：

  10.1007/bf00697142
• 作为产物：
  描述：

  N,N-dibromo-(tert-butyl)-amine 、 1,3,5-三溴-2-亚硝基-苯 以 二氯甲烷 为溶剂， 以94%的产率得到2,4,6-tribromo(tert-butyl-NNO-azoxy)benzene
  参考文献：
  名称：

  Synthesis of brominated 2-(tert-butyl-NNO-azoxy)anilmes

  摘要：

  2-(tert-Butyl-NNO-azoxy)aniline was prepared by selective reduction of 2-(tert-butyl-NNO-azoxy)nitrobenzene. Its bromination yielded the corresponding para-bromo- and ortho,para-dibromoanilines (3a,b). meta-Bromoanilines (6a,b) were synthesized by selective replacement of the ortho-bromine atoms in ortho,para-bromo(tert-butylazoxy)benzene (5a,b) by ammonia in toluene under pressure.

  DOI：

  10.1007/bf00697142

文献信息

• Synthesis of brominated 2-(tert-butyl-NNO-azoxy)anilmes
  作者：A. M. Churakov、O. Yu. Smirnov、S. L. Ioffe、Yu. A. Strelenko、V. A. Tartakovsky

  DOI：10.1007/bf00697142

  日期：1994.9

  2-(tert-Butyl-NNO-azoxy)aniline was prepared by selective reduction of 2-(tert-butyl-NNO-azoxy)nitrobenzene. Its bromination yielded the corresponding para-bromo- and ortho,para-dibromoanilines (3a,b). meta-Bromoanilines (6a,b) were synthesized by selective replacement of the ortho-bromine atoms in ortho,para-bromo(tert-butylazoxy)benzene (5a,b) by ammonia in toluene under pressure.