5a-hydroxy-9-nitro-5aH-indeno[2,1-b]benzo-1,4-oxazin-5-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 英文名称: 5a-hydroxy-9-nitro-5aH-indeno[2,1-b]benzo-1,4-oxazin-5-one
• 英文别名: 10a-Hydroxy-7-nitroindeno[2,1-b][1,4]benzoxazin-11-one
• 化学式: C₁₅H₈N₂O₅
• 分子量: 296.239
• InChiKey: GKZVLYNVKCLNMZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  22
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  105
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  水合茚三酮 、 2-氨基-4-硝基苯酚 以 异丙醇 为溶剂， 反应 2.0h， 以75%的产率得到5a-hydroxy-9-nitro-5aH-indeno[2,1-b]benzo-1,4-oxazin-5-one
  参考文献：
  名称：

  摘要：

  Condensation of ortho-aminophenols and N-benzylsulfonyl-o-phenylenediamine with nin-hydrin afforded tetracyclic products, the amino group entering into condensation with the carbonyl group at position 1 of ninhydrin. The structures of the reaction products were established by H-1 NMR spectroscopy and X-ray diffraction analysis.

  DOI：

  10.1023/a:1011333722238

文献信息

• ——
  作者：V. I. Simakov、S. V. Kurbatov、O. Ya. Borbulevych、M. Yu. Antipin、L. P. Olekhnovich

  DOI：10.1023/a:1011333722238

  日期：——

  Condensation of ortho-aminophenols and N-benzylsulfonyl-o-phenylenediamine with nin-hydrin afforded tetracyclic products, the amino group entering into condensation with the carbonyl group at position 1 of ninhydrin. The structures of the reaction products were established by H-1 NMR spectroscopy and X-ray diffraction analysis.