1,8-bis(isonicotinyloxy)anthracene-9,10-dione | 1100242-19-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 1,8-bis(isonicotinyloxy)anthracene-9,10-dione
• 英文别名: [9,10-Dioxo-8-(pyridine-4-carbonyloxy)anthracen-1-yl] pyridine-4-carboxylate
• CAS: 1100242-19-0
• 化学式: C₂₆H₁₄N₂O₆
• 分子量: 450.407
• InChiKey: GHBLHMRRHOCPOS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  113
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  tetrakis(acetonitrile)copper(I)tetrafluoroborate 、 1,8-bis(isonicotinyloxy)anthracene-9,10-dione 以 乙腈 为溶剂， 生成 [Cu2(1,8-bis(isonicotinyloxy)anthracene-9,10-dione)2(CH3CN)2](BF4)2
  参考文献：
  名称：

  Chelating, bridging, and chain structures within Ag(I) and Cu(I) complexes of bis(nicotinyloxy), bis(isonicotinyloxy), and bis(pyrimidine-5-carboxyloxy)-1,8-disubstituted anthraquinone ligands

  摘要：

  Reaction of Ag(I) and Cu(I) [M(NCCH3)(4)]X (X = BF4- and PF6-) salts with 1,8-bis(nicotinyloxy)anthracene-9,10-dione (1), 1,8-bis(isonicotinyloxy)anthracene-9,10-dione (2), and 1,8-bis(pyrimidine-5-carboxyloxy)anthracene-9,10-dione (3), yield new chelating and bridging complexes and two new coordination polymers. The bridging capabilities of ligands 1 and 2 have not been demonstrated before, and ligand 1, by itself, has the flexibility to produce either chelated or bridged structures and an unusual ladder coordination polymer. The tetradentate ligand 3 also produces a one-dimensional coordination polymer in the presence of one equivalent of Ag(I). All complexes have been characterized by X-ray crystallography. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2009.06.024