copper tetra-4-phenoxytetra-5-(4-undecyloxybenzoylamino)phthalocyanine | 769970-43-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: copper tetra-4-phenoxytetra-5-(4-undecyloxybenzoylamino)phthalocyanine
• 英文别名: Cu[tetra-4-phenoxy-tetra-5-(4-undecyloxybenzoylamino)phthalocyanine]
• CAS: 769970-43-6
• 化学式: C₁₂₈H₁₄₀CuN₁₂O₁₂
• 分子量: 2102.14
• InChiKey: DFNOEKDVOIJWSG-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  33.94
• 重原子数：
  153.0
• 可旋转键数：
  60.0
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.34
• 拓扑面积：
  295.78
• 氢给体数：
  4.0
• 氢受体数：
  18.0

反应信息

• 作为产物：
  描述：

  4-phenoxy-5-(4-undecyloxybenzoylamino)phthalonitrile 在 copper salt 作用下， 反应 1.0h， 以35%的产率得到copper tetra-4-phenoxytetra-5-(4-undecyloxybenzoylamino)phthalocyanine
  参考文献：
  名称：

  Metal Phthalocyanines with Undecyloxybenzoic Acid Residues, and Their Mesomorphic Properties

  摘要：

  Acylation of 4-amino-5-nitro-, 5-amino-4-bromo-, 5-amino-4-phenoxy-, 4-hydroxy-5-nitro-, 3- and 4-hydroxyphtalonitriles with p-undecyloxybenzoyl chloride gave the corresponding acyl derivatives which were used to prepare copper and cobalt phthalocyanines. Physicochemical properties of the resulting products were studied. The synthesized metal complexes all exhibit mesomorphic properties.

  DOI：

  10.1023/b:rugc.0000025520.29732.9e

文献信息

• Bifunctional octasubstituted phthalocyanines. Synthesis and properties
  作者：G. P. Shaposhnikov、V. E. Maizlish、V. P. Kulinich

  DOI：10.1134/s1070363207010215

  日期：2007.1

  Data on the synthesis of bifunctional octasubstituted phthalocyanines are reported. Some specificities of their electronic absorption spectra, thermal stability, and other properties, depending on the substituent nature and central metal ion, are revealed.