2,3,7,8,12,13,17,18-octakis(1-naphthylmethylthio) H(21),H(23) porhyrazine | 736140-01-5

• 英文名称: 2,3,7,8,12,13,17,18-octakis(1-naphthylmethylthio) H(21),H(23) porhyrazine
• CAS: 736140-01-5
• 化学式: C₁₀₄H₇₄N₈S₈
• 分子量: 1692.31
• InChiKey: WSRGIAGDGZGGDY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  29.67
• 重原子数：
  120.0
• 可旋转键数：
  24.0
• 环数：
  21.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  108.92
• 氢给体数：
  2.0
• 氢受体数：
  14.0

反应信息

• 作为反应物：
  描述：

  2,3,7,8,12,13,17,18-octakis(1-naphthylmethylthio) H(21),H(23) porhyrazine 、 copper diacetate 以 乙醇 、 氯仿 为溶剂， 以33%的产率得到2,3,7,8,12,13,17,18-octakis(1-naphthylmethylthio)-porhyrazinatocopper(II)
  参考文献：
  名称：

  Octakis(1-naphthylmethylthio) substituted porphyrazine derivatives

  摘要：

  Magnesium porphyrazinate substituted with eight (1-naphthylmethylthio)groups on the peripheral positions has been synthesized by cyclotetramerization of 1,2-bis(1-naphthylmethylthio)maleonitrile in the presence of magnesium butanolate. The metal-free derivative was obtained by its treatment with trifluoroacetic acid and further reaction of this product with copper(II) acetate, zinc(II) acetate and cobalt(II) acetate led to the metal porphyrazinates (M=Cu, Zn, Co). These new compounds have been characterized by elemental analysis, together with FT-IR, H-1 NMR, UV-Vis and EPR spectral data. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2004.05.001