(1E)-3-acetyl-1,3-bis(2-chloro-4-nitrophenyl)-1-triazene

• 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: (1E)-3-acetyl-1,3-bis(2-chloro-4-nitrophenyl)-1-triazene
• 化学式: C₁₄H₉Cl₂N₅O₅
• 分子量: 398.162
• InChiKey: BHFSSFUJXXYCQR-ISLYRVAYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.86
• 重原子数：
  26.0
• 可旋转键数：
  5.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  131.31
• 氢给体数：
  0.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  苄胺 、 (1E)-3-acetyl-1,3-bis(2-chloro-4-nitrophenyl)-1-triazene 以 乙腈 为溶剂， 反应 11.5h， 以91%的产率得到N-苄基乙酰胺
  参考文献：
  名称：

  3-Acyl-1,3-diaryltriazenes as neutral and selective acylating agents

  摘要：

  New 3-acyl-1,3-diaryltriazenes have been prepared and their reactions with amino compounds have been studied. Reactions proceed rapidly under mild conditions to give the corresponding N-acyl products: Reagents enable chemoselective acylation of aliphatic primary and secondary amines in the presence of other acylable functional groups. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(01)01358-2
• 作为产物：
  描述：

  乙酰氯 、 1,3-bis(2-chloro-4-nitrophenyl)triazene 在 sodium carbonate 作用下， 以 乙腈 为溶剂， 反应 12.0h， 以88%的产率得到(1E)-3-acetyl-1,3-bis(2-chloro-4-nitrophenyl)-1-triazene
  参考文献：
  名称：

  3-Acyl-1,3-diaryltriazenes as neutral and selective acylating agents

  摘要：

  New 3-acyl-1,3-diaryltriazenes have been prepared and their reactions with amino compounds have been studied. Reactions proceed rapidly under mild conditions to give the corresponding N-acyl products: Reagents enable chemoselective acylation of aliphatic primary and secondary amines in the presence of other acylable functional groups. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(01)01358-2

文献信息

• An axial chirality and disorder of positional isomers in a crystal of highly cytotoxic 3-acetyl-1,3-bis(2-chloro-4-nitrophenyl)-1E-triazene
  作者：Krešimir Molčanov、Slovenko Polanc、Maja Osmak、Biserka Kojić-Prodić

  DOI：10.17344/acsi.2015.1420

  日期：2015.6.15

  Biologically active 4-nitro-substituted 1,3-diaryltriazene, a chemical analogue of 1,3-bis(4'-amidinophenyl)-triazene-berenil®, belongs to the novel, chemically modified class of potent antitumor agents. Its structural characterization by X-ray analysis and 1H NMR spectroscopy is performed to determine molecular overall conformation in view of its possible interaction to DNA.
• 3-Acyl-1,3-diaryltriazenes as neutral and selective acylating agents
  作者：Bogdan Štefane、Urh Černigoj、Marijan Kočevar、Slovenko Polanc

  DOI：10.1016/s0040-4039(01)01358-2

  日期：2001.9

  New 3-acyl-1,3-diaryltriazenes have been prepared and their reactions with amino compounds have been studied. Reactions proceed rapidly under mild conditions to give the corresponding N-acyl products: Reagents enable chemoselective acylation of aliphatic primary and secondary amines in the presence of other acylable functional groups. (C) 2001 Elsevier Science Ltd. All rights reserved.
• Synthesis and Characterization of New Triazenide Salts
  作者：Andrej Virag、Anton Meden、Marijan Kočevar、Slovenko Polanc

  DOI：10.1021/jo060178p

  日期：2006.5.1

  Stable triethylammonium triazenide salts were obtained on treatment of the appropriate triazenes with triethylamine. Those salts are described and fully characterized for the first time and are used for the preparation of alkoxycarbonylvinyltriethylammonium triazenides, which are prone to transesterification.