6,9-dibromo-1-nitro-3-(trifluoromethyl)-10H-phenothiazine | 1020745-90-7

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: 6,9-dibromo-1-nitro-3-(trifluoromethyl)-10H-phenothiazine
• CAS: 1020745-90-7
• 化学式: C₁₃H₅Br₂F₃N₂O₂S
• 分子量: 470.064
• InChiKey: OIEPKPUZXXGYOP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  23
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  83.2
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  1-乙酰氧基-2,3,5-三苯甲酰氧基-1-beta-D-呋喃核糖 、 6,9-dibromo-1-nitro-3-(trifluoromethyl)-10H-phenothiazine 以 甲苯 为溶剂， 反应 10.0h， 以19%的产率得到[(2R,3R,4R,5R)-3,4-dibenzoyloxy-5-[6,9-dibromo-1-nitro-3-(trifluoromethyl)phenothiazin-10-yl]oxolan-2-yl]methyl benzoate
  参考文献：
  名称：

  Synthesis of Some Substituted 10H-Phenothiazines, Ribofuranosides, and their Antioxidant Activity

  摘要：

  10H-substituted phenothiazines were prepared by Smiles rearrangement. These prepared phenothiazines were used as base to prepare ribofuranosides by treatment with sugar. Their antioxidant activity was carried out. The structure of both 10H-Phenothiazines and ribofuranosides was established by spectroscopic data and optical rotation data.

  DOI：

  10.1080/10426500601161023
• 作为产物：
  描述：

  在 氢氧化钾 作用下， 以 乙醇 、 丙酮 为溶剂， 反应 4.5h， 以33%的产率得到6,9-dibromo-1-nitro-3-(trifluoromethyl)-10H-phenothiazine
  参考文献：
  名称：

  Synthesis of Some Substituted 10H-Phenothiazines, Ribofuranosides, and their Antioxidant Activity

  摘要：

  10H-substituted phenothiazines were prepared by Smiles rearrangement. These prepared phenothiazines were used as base to prepare ribofuranosides by treatment with sugar. Their antioxidant activity was carried out. The structure of both 10H-Phenothiazines and ribofuranosides was established by spectroscopic data and optical rotation data.

  DOI：

  10.1080/10426500601161023