2-[[[(4,9-Dioxobenzo[f]benzotriazol-2-yl)imino-diphenyl-lambda5-phosphanyl]methyl-diphenyl-lambda5-phosphanylidene]amino]benzo[f]benzotriazole-4,9-dione

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-[[[(4,9-Dioxobenzo[f]benzotriazol-2-yl)imino-diphenyl-lambda5-phosphanyl]methyl-diphenyl-lambda5-phosphanylidene]amino]benzo[f]benzotriazole-4,9-dione
• 英文别名: 2-[[[(4,9-dioxobenzo[f]benzotriazol-2-yl)imino-diphenyl-λ5-phosphanyl]methyl-diphenyl-λ5-phosphanylidene]amino]benzo[f]benzotriazole-4,9-dione
• 化学式: C₄₅H₃₀N₈O₄P₂
• 分子量: 808.732
• InChiKey: NLVAVVSZOHSAIO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.4
• 重原子数：
  59
• 可旋转键数：
  8
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.02
• 拓扑面积：
  154
• 氢给体数：
  0
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  2,3-二氯-1,4-萘醌 在 sodium azide 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 反应 2.5h， 生成 2-[[[(4,9-Dioxobenzo[f]benzotriazol-2-yl)imino-diphenyl-lambda5-phosphanyl]methyl-diphenyl-lambda5-phosphanylidene]amino]benzo[f]benzotriazole-4,9-dione
  参考文献：
  名称：

  Synthesis of 2-Amino-1,2,3-triazole Derivatives from Vicinal Diazides

  摘要：

  Triphenylphosphine reacts with naphthoquinone diazide to form almost quantitatively the phosphorane of a unique 2-amino-1,2,3-triazole derivative. This compound undergoes an aza-Wittig reaction with aldehydes and is readily hydrolyzed to the free 2-amino-1,2,3-triazole. The free amine reacts normally with acids and aldehydes, The 2-amino-1,2,3-triazole system is stable and high melting, and most derivatives give the parent ion as the largest peak in the mass spectrum. The compounds absorb at 300-350 nm with a strong emission in the range 500-700 nm, depending upon the substituents. Cyclic voltammetry shows one reversible, single-electron reduction wave.

  DOI：

  10.1021/jo970197m