4-[2-[4-[Tris[4-[2-(4-carboxyphenyl)ethynyl]phenyl]methyl]phenyl]ethynyl]benzoic acid | 1252593-11-5

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: 4-[2-[4-[Tris[4-[2-(4-carboxyphenyl)ethynyl]phenyl]methyl]phenyl]ethynyl]benzoic acid
• 英文别名: 4-[2-[4-[tris[4-[2-(4-carboxyphenyl)ethynyl]phenyl]methyl]phenyl]ethynyl]benzoic acid
• CAS: 1252593-11-5
• 化学式: C₆₁H₃₆O₈
• 分子量: 896.952
• InChiKey: FUVQBDCRAGNDAO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.2
• 重原子数：
  69
• 可旋转键数：
  16
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.02
• 拓扑面积：
  149
• 氢给体数：
  4
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  水 、 N,N-二乙基甲酰胺 、 4-[2-[4-[Tris[4-[2-(4-carboxyphenyl)ethynyl]phenyl]methyl]phenyl]ethynyl]benzoic acid 、 copper(II) nitrate trihydrate 以 further solvent(s) 为溶剂， 生成 [Cu2(C(C6H4CCC6H4CO2)4)(H2O)2]*12(diethylformamide)*26H2O
  参考文献：
  名称：

  Three-Dimensional Metal−Organic Frameworks Based on Tetrahedral and Square-Planar Building Blocks: Hydrogen Sorption and Dye Uptake Studies

  摘要：

  Two three-dimensional metal organic frameworks (MOFs) with tetraphenylmethane-derived tetracarboxylate linkers and copper paddle-wheel secondary building units were synthesized and characterized by single-crystal X-ray crystallographic studies. The two MOFs show a similar 4,4-connectivity but very different homocrossing and interpenetrating PtS network topologies and exhibit permanent porosity as probed by gas adsorption and dye inclusion experiments.

  DOI：

  10.1021/ic1009169

文献信息

• Three-Dimensional Metal−Organic Frameworks Based on Tetrahedral and Square-Planar Building Blocks: Hydrogen Sorption and Dye Uptake Studies
  作者：Demin Liu、Zhigang Xie、Liqing Ma、Wenbin Lin

  DOI：10.1021/ic1009169

  日期：2010.10.18

  Two three-dimensional metal organic frameworks (MOFs) with tetraphenylmethane-derived tetracarboxylate linkers and copper paddle-wheel secondary building units were synthesized and characterized by single-crystal X-ray crystallographic studies. The two MOFs show a similar 4,4-connectivity but very different homocrossing and interpenetrating PtS network topologies and exhibit permanent porosity as probed by gas adsorption and dye inclusion experiments.