1,8,15,22-tetra-(2-pyridylthio)phthalocyanine | 1385084-32-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: 1,8,15,22-tetra-(2-pyridylthio)phthalocyanine
• 英文别名: 5,14,23,32-Tetrakis(pyridin-2-ylsulfanyl)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene；5,14,23,32-tetrakis(pyridin-2-ylsulfanyl)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene
• CAS: 1385084-32-1
• 化学式: C₅₂H₃₀N₁₂S₄
• 分子量: 951.155
• InChiKey: AMKBKPDAIJWDHT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.7
• 重原子数：
  68
• 可旋转键数：
  8
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  262
• 氢给体数：
  2
• 氢受体数：
  14

反应信息

• 作为产物：
  描述：

  3-(2-mercaptopyridine)phthalonitrile 在 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 戊醇 为溶剂， 反应 20.0h， 以36%的产率得到1,8,15,22-tetra-(2-pyridylthio)phthalocyanine
  参考文献：
  名称：

  Synthesis and photophysical properties of peripherally and non-peripherally mercaptopyridine substituted metal free, Mg(II) and Al(III) phthalocyanines

  摘要：

  The syntheses and photophysical properties of metallophthalocyanines containing Mg2+ and Al3+ as central metal ions and their unmetallated derivative (complexes 3-8) tetra- substituted at the non-peripheral (alpha) and peripheral (beta) positions with 2-mercaptopyridine are reported. The trends in triplet and fluorescence quantum yields are described for these compounds. The complexes exhibited relatively high triplet quantum yields (Phi(T)) ranging from 0.33 to 0.54 and fluorescence quantum yields (Phi(F)) ranging from 0.02 to 0.29. Triplet state lifetimes of the complexes were long ranging from 120 to 460 mu s, indicating a potential use of these complexes as photosensitizers. (C) 2012 Elsevier By. All rights reserved.

  DOI：

  10.1016/j.saa.2012.04.004

文献信息

• Synthesis and photophysical properties of peripherally and non-peripherally mercaptopyridine substituted metal free, Mg(II) and Al(III) phthalocyanines
  作者：Yasin Arslanoğlu、Mopelola Idowu、Tebello Nyokong

  DOI：10.1016/j.saa.2012.04.004

  日期：2012.9

  The syntheses and photophysical properties of metallophthalocyanines containing Mg2+ and Al3+ as central metal ions and their unmetallated derivative (complexes 3-8) tetra- substituted at the non-peripheral (alpha) and peripheral (beta) positions with 2-mercaptopyridine are reported. The trends in triplet and fluorescence quantum yields are described for these compounds. The complexes exhibited relatively high triplet quantum yields (Phi(T)) ranging from 0.33 to 0.54 and fluorescence quantum yields (Phi(F)) ranging from 0.02 to 0.29. Triplet state lifetimes of the complexes were long ranging from 120 to 460 mu s, indicating a potential use of these complexes as photosensitizers. (C) 2012 Elsevier By. All rights reserved.