5-[3,6,7,10,11-Pentakis(4-carboxybutoxy)triphenylen-2-yl]oxypentanoic acid | 1325232-70-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 5-[3,6,7,10,11-Pentakis(4-carboxybutoxy)triphenylen-2-yl]oxypentanoic acid
• CAS: 1325232-70-9
• 化学式: C₄₈H₆₀O₁₈
• 分子量: 924.994
• InChiKey: KZOYYINCHLRMTK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  66
• 可旋转键数：
  36
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  279
• 氢给体数：
  6
• 氢受体数：
  18

反应信息

• 作为反应物：
  描述：

  [(FeSalophen)₂O] 、 5-[3,6,7,10,11-Pentakis(4-carboxybutoxy)triphenylen-2-yl]oxypentanoic acid 以 乙醇 为溶剂， 以64%的产率得到[C18H6(O(CH2)4COO(iron(bis(salicylidene)-o-phenylenediamine)))6]
  参考文献：
  名称：

  The (salophen)-bridged Fe/Cr (III) capped complexes with triphenylene core: Synthesis and characterization

  摘要：

  This article describes synthesis of the difference carboxylic acid derivatives of triphenylene and its complexation properties with Fe/Cr (III)-salophen. For this purpose, the carboxylic acid derivatives of 2,3,6,7,10,11-hexahydroxytriphenylene were synthesized and then reacted with four new Fe(III) and Cr(III) complexes involving tetradenta Schiff bases bis(salicylidene)-o-phenylenediamine-(salophenH(2)). The prepared compounds were characterized by means of elemental analysis carrying out infrared spectroscopy (IR), thermogravimetric analysis (TG), nuclear magnetic resonance (H-1 NMR), elemental analysis and magnetic susceptibility measurement. The complexes can also be characterized as low-spin distorted octahedral Fe(III) and Cr (III) bridged by carboxylic acids. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2011.06.020
• 作为产物：
  描述：

  hexamethyl 5,5',5'',5''',5'''',5'''''-(triphenylene-2,3,6,7,10,11-hexaylhexakis(oxy))hexapentanoate 在 水 、 sodium hydroxide 作用下， 以 乙醇 为溶剂， 反应 24.0h， 以50%的产率得到5-[3,6,7,10,11-Pentakis(4-carboxybutoxy)triphenylen-2-yl]oxypentanoic acid
  参考文献：
  名称：

  The (salophen)-bridged Fe/Cr (III) capped complexes with triphenylene core: Synthesis and characterization

  摘要：

  This article describes synthesis of the difference carboxylic acid derivatives of triphenylene and its complexation properties with Fe/Cr (III)-salophen. For this purpose, the carboxylic acid derivatives of 2,3,6,7,10,11-hexahydroxytriphenylene were synthesized and then reacted with four new Fe(III) and Cr(III) complexes involving tetradenta Schiff bases bis(salicylidene)-o-phenylenediamine-(salophenH(2)). The prepared compounds were characterized by means of elemental analysis carrying out infrared spectroscopy (IR), thermogravimetric analysis (TG), nuclear magnetic resonance (H-1 NMR), elemental analysis and magnetic susceptibility measurement. The complexes can also be characterized as low-spin distorted octahedral Fe(III) and Cr (III) bridged by carboxylic acids. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2011.06.020