2,2',2'',2''',2'''',2'''''-(((((1,3,5,2l5,4l5,6l5-triazatriphosphinine-2,2,4,4,6,6-hexayl)hexakis(oxy))hexakis(5-chlorobenzene-2,1-diyl))hexakis(methaneylylidene))hexakis(azaneylylidene))hexakis(4-chlorophenol) | 1443380-80-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2,2',2'',2''',2'''',2'''''-(((((1,3,5,2l5,4l5,6l5-triazatriphosphinine-2,2,4,4,6,6-hexayl)hexakis(oxy))hexakis(5-chlorobenzene-2,1-diyl))hexakis(methaneylylidene))hexakis(azaneylylidene))hexakis(4-chlorophenol)
• CAS: 1443380-80-0
• 化学式: C₇₈H₄₈Cl₁₂N₉O₁₂P₃
• 分子量: 1821.65
• InChiKey: CXFLRVIDYHZXNY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  28.89
• 重原子数：
  114.0
• 可旋转键数：
  24.0
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  288.0
• 氢给体数：
  6.0
• 氢受体数：
  21.0

反应信息

• 作为产物：
  描述：

  hexa(4-chloro-2-formylphenoxy)cyclotriphosphazene 、 4-氯-2-氨基苯酚 在 甲酸 作用下， 以 四氢呋喃 为溶剂， 反应 48.0h， 以80%的产率得到2,2',2'',2''',2'''',2'''''-(((((1,3,5,2l5,4l5,6l5-triazatriphosphinine-2,2,4,4,6,6-hexayl)hexakis(oxy))hexakis(5-chlorobenzene-2,1-diyl))hexakis(methaneylylidene))hexakis(azaneylylidene))hexakis(4-chlorophenol)
  参考文献：
  名称：

  Synthesis, Characterization, and Spectroscopic Properties of Hexa(4-Bromo-2-Formyl-Phenoxy)Cyclotriphosphazene and Hexa(4-Chloro-2-Formyl-Phenoxy)Cyclotriphosphazene and Fully Substituted Cyclotriphosphazene Derivatives Bearing a Schiff Base at Room Temperature

  摘要：

  Hexa(4-bromo-2-formyl-phenoxy)cyclotriphosphazene (2) and hexa(4-chloro-2- formyl-phenoxy)cyclotriphosphazene (3) were obtained from the reactions of hexachloro- cyclotriphosphazene (1) with 5-bromosalicylaldehyde and 5-chlorosalicylaldehyde in the presence of (C2H5)(3)N and K2CO3 at room temperature, respectively. The new two organocyclotriphosphazenes bearing formyl groups were reacted with 4-cyano aniline, 2-phenyl aniline, 4-aceto aniline, 5-chloro-2-hydroxy aniline, 2-hydroxy aniline, 4-hydroxy aniline, 2-(4-morpholino)ethyl amine, 4-carboxy aniline, 4-carbomoyl aniline, 2-mercapto aniline, and 5-amino isoquonoline to prepare cyclotriphosphazene derivatives containing a Schiff base at room temperature. However, fully phenoxy-substituted cyclotriphosphazenes containing a Schiff base were isolated from the reactions of the compound 2 and 3 with 5-chloro-2-hydroxy aniline, 2-hydroxy aniline, 4-hydroxy aniline, and 2-(4-morpholino)ethyl amine. The structures of the synthesized compounds were characterized by elemental analysis, IR, and NMR (H-1, C-13, P-31) spectroscopy. According to the results of the analysis, all synthesized compounds were found to be fully substituted organocyclotriphosphazenes, such as hexa[4-bromo-2-(5-chloro-2-hydroxy-pheyliminomethyl)phenoxy]cyclotriphosphaze (2a). All cyclotriphosphazene derivatives synthesized gave fluorescence emission peaks in range between 300nm and 410nm.

  DOI：

  10.1080/10426507.2012.692132