copper(II)-phthalocyanine-tetrasulfonic acid | 67462-31-1

• 分子结构分类: 有机化合物 - 有机金属化合物
• 英文名称: copper(II)-phthalocyanine-tetrasulfonic acid
• 英文别名: (tetrasulphonatophthalocyaninato)Cu(II)(4-)；copper-phthalocyanine-tetrasulfonate(4-)；Cu(II)-PcTS
• CAS: 67462-31-1
• 化学式: C₃₂H₁₂CuN₈O₁₂S₄
• 分子量: 892.304
• InChiKey: VBCJYUJAYAXDNK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.77
• 重原子数：
  23.0
• 可旋转键数：
  0.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  399.0
• 氢给体数：
  6.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  copper dichloride 、 4'-(2,3-dihydroxypropylthio)-phthalonitrile 以 further solvent(s) 为溶剂， 以24.5%的产率得到copper(II)-phthalocyanine-tetrasulfonic acid
  参考文献：
  名称：

  外围和非外围设计的多功能酞菁；合成，电化学，光谱电化学和金属离子结合研究

  摘要：

  摘要一种新型的离子载体配体3'-（2,3-二羟丙基硫代）-邻苯二甲腈和4'（2,3-二羟丙基硫代）-邻苯二甲腈及其α-和β-四取代金属酞菁（M制备了ZnII，CoII，MnIIICl，FeIIIAc，CuII），并通过元素分析，FT-IR，1H和13C NMR和MS（ESI和Maldi-TOF）进行了全面表征。该络合物可溶于极性和非极性溶剂，例如MeOH和EtOH，THF，CHCl3和CH2Cl2。配合物的光谱性质受到酞菁外围的给电子硫烷基单元的强烈影响。配合物的阳离子结合特性，例如使用AgI和PdII，通过UV-Vis光谱进行了评估，结果表明形成了多核酞菁配合物。锌和铜配合物外围的功能性供体与AgI和PdII配位，得到大约。浓度为2.5×10-5 M（Pc）和1.0×10-3 M（金属离子）时，金属与酞菁配合物的比率为2：1。进行伏安法和原位光谱电化学研究以表征配合物的氧化还原行为。应用

  DOI：

  10.1016/j.poly.2011.01.030

文献信息

• The synthesis and characterization of new organosoluble long chain-substituted metal-free and metallophthalocyanines by microwave irradiation
  作者：Zekeriya Bıyıklıoğlu、Halit Kantekin、İrfan Acar

  DOI：10.1016/j.inoche.2008.10.006

  日期：2008.12

  metallophtalocyanines ( 5 – 8 ) have been synthesized by cyclotetramerization reaction of phthalonitrile derivative ( 3 ). Long chain-substituted Pcs showed the enhanced solubility in organic solvents. The new compounds were characterized by a combination of IR, 1 H NMR, 13 C NMR, UV–Vis, elemental analysis and MS spectral data.

  摘要 采用N,N-双[2-(2-羟基乙氧基)乙基]-4-甲基苯磺酰胺(1)亲核置换4-硝基邻苯二甲腈中的硝基，合成了长链取代的邻苯二甲腈(3)。通过邻苯二甲腈衍生物（3）的环四聚反应合成了新型的无金属酞菁（4）和金属酞菁（5-8）。长链取代的 Pcs 在有机溶剂中显示出增强的溶解性。新化合物通过 IR、1 H NMR、13 C NMR、UV-Vis、元素分析和 MS 光谱数据的组合进行表征。
• 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.
• Bykova; Usol'tseva; Anan'eva, Russian Journal of General Chemistry, 2000, vol. 70, # 1, p. 145 - 147
  作者：Bykova、Usol'tseva、Anan'eva、Smirnova、Shaposhnikov、Maizlish

  DOI：——

  日期：——
• New long-chain-substituted polymeric metal-free and metallophthalocyanines by microwave irradiation: Synthesis and characterization
  作者：Zekeriya Bıyıklıoğlu、Halit Kantekin

  DOI：10.1016/j.poly.2008.02.010

  日期：2008.4

  A tetranitrile monomer N,N-bis2-[2-(3,4-dicyanophenoxy)ethoxy]ethyl}-4-methylbenzenesulfonamide (3) was synthesized by nucleophilic aromatic substitution of N,N-bis[2-(2-hydroxyethoxy)ethyl]-4-methylbenzenesulfonamide (1) onto 4-nitrophthalonitrile (2). The metal-free phthalocyanine polymer (4) was prepared by the reaction of a tetranitrile monomer 3 in 2-(dimethylamino)ethanol. Ni(II), Co(II) and Cu(II) phthalocyanine polymers were prepared by the reaction of the tetranitrile compound with the chlorides of Ni(11), Co(II) and Cu(II) in 2-(dimethylamino)ethanol (DMAE). The Zn(II)-phthalocyanine polymer was prepared by the reaction of the tetranitrile compound with the acetate of Zn(II) in DMAE. The new compounds were characterized by a combination of IR, (1)H NMR, (13)C NMR, UV-Vis, elemental analysis and MS spectral data. (C) 2008 Elsevier Ltd. All rights reserved.