acetylacetonato(22,23,72,73,122,123,172,173-octaphenyltetrapyrazino[b,g,l,q]-5,10,15,20-tetraazaporphyrinato)lutetium(III) | 1127415-21-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: acetylacetonato(22,23,72,73,122,123,172,173-octaphenyltetrapyrazino[b,g,l,q]-5,10,15,20-tetraazaporphyrinato)lutetium(III)
• 英文别名: acetylacetonato(octaphenyltetrapyrazinoporphyrazinato)lutetium(III)
• CAS: 1127415-21-7
• 化学式: C₅H₇O₂*C₇₂H₄₀N₁₆*Lu
• 分子量: 1403.29
• InChiKey: JQQJQRDUBKZGGP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.99
• 重原子数：
  96.0
• 可旋转键数：
  10.0
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.03
• 拓扑面积：
  242.8
• 氢给体数：
  0.0
• 氢受体数：
  16.0

反应信息

• 作为反应物：
  描述：

  acetylacetonato(22,23,72,73,122,123,172,173-octaphenyltetrapyrazino[b,g,l,q]-5,10,15,20-tetraazaporphyrinato)lutetium(III) 、 三氟乙酸 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Acid base interactions of octaphenyltetrapyrazinoporphyrazine and its complex with lutetium(III) in proton-donor media

  摘要：

  Acid-base interactions of octaphenyltetrapyrazinoporphyrazine and its complex with lutetium(III) in acetic and trifluoroacetic acid media were studied, and parameters characterizing equilibria between the acid and base forms were determined. Acid-base interactions of octaphenyltetrapyrazinoporphyrazine involve primarily nitrogen atoms in the pyrazine fragments, while its lutetium(III) complex undergoes protonation at the meso-nitrogen atoms.

  DOI：

  10.1134/s1070363207120183
• 作为产物：
  描述：

  tris(acetylacetonato)-lutetium(III) 、 2,3-二氰基-5,6-二苯基吡嗪 在 sodium methylate 、 尿素 作用下， 以 苯甲腈 为溶剂， 以88%的产率得到acetylacetonato(22,23,72,73,122,123,172,173-octaphenyltetrapyrazino[b,g,l,q]-5,10,15,20-tetraazaporphyrinato)lutetium(III)
  参考文献：
  名称：

  Synthesis and properties of lanthanide complexes with tetrapyrazinoporphyrazine and its substituted derivatives

  摘要：

  Reactions of dicyanopyrazine and its tert-butyl-, diphenyl-, and dipyridyl-substituted derivatives with erbium, thulium, ytterbium, and lutetium chlorides, acetates, and acetylacetonates gave the corresponding tetrapyrazinoporphyrazine metal complexes which were characterized by elemental analyses, and IR, H-1 NMR, and electronic absorption spectra. The stability of the complexes to thermooxidative decomposition in air was also studied.

  DOI：

  10.1134/s1070363207110175