9-(4-(tetradecyloxy)-4'-azabenzenamino)-4,5-diazafluorene | 351327-06-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 偶氮苯
• 英文名称: 9-(4-(tetradecyloxy)-4'-azabenzenamino)-4,5-diazafluorene
• 英文别名: N-[4-[(4-tetradecoxyphenyl)diazenyl]phenyl]-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-imine
• CAS: 351327-06-5
• 化学式: C₃₇H₄₃N₅O
• 分子量: 573.781
• InChiKey: ZWJFMVJXUCFQJS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.2
• 重原子数：
  43
• 可旋转键数：
  17
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  72.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  ammonium hexafluorophosphate 、 顺-双(2,2'-二吡啶基)二氯化钌(II)二水合物 、 9-(4-(tetradecyloxy)-4'-azabenzenamino)-4,5-diazafluorene 以 甲醇 、 乙醇 为溶剂， 以65%的产率得到[Ru(bpy)2(9-(4-(tetradecyloxy)-4'-azabenzenamino)-4,5-diazafluorene)](PF6)2
  参考文献：
  名称：

  Synthesis, Characterization, Langmuir−Blodgett Film-Forming Properties, and Second-Harmonic-Generation Studies of Ruthenium(II) Complexes with Long Hydrocarbon Chains

  摘要：

  Several ruthenium(II) surfactants of general formula [Ru(bpy)(2)L](2+) [L = N-(2-pyridylmethylene)-3,4-bis(tetradecyloxy)benzenamine, N-(2-pyridylmethylene)-3,4-bis(octadecyloxy)benzenamine, 9-(3,4-bis(tetradecyloxy)-benzenamino)-4,5-diazafluorene, 9-(4-(tetradecyloxy)-4 ' -azabenzenamino)-4,5-diazafluorene, 4,7-dinonadecyl-1,10-phenanthroline] and [Ru(L)(3)](2+) (L = 4,7-dinonadecyl-1,10-phenanthroline) were synthesized and characterized by elemental analysis, H-1 NMR, W-vis, luminescence spectroscopy, and cyclic voltammetry. Their Langmuir-Blodgett (LB) film formation properties and surface pressure-area (pi -A) isotherms were also studied. Two complexes were found to show second-harmonic-generation (SHG) behavior.

  DOI：

  10.1021/ic001326b