2,7-diamino-5,9-dihydro-dibenzo[de,ij][2,6]naphthyridine-5,10-dione | 55621-48-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 2,7-diamino-5,9-dihydro-dibenzo[de,ij][2,6]naphthyridine-5,10-dione
• 英文别名: 2,7-Diamino-5,9-dihydro-dibenzo[de,ij][2,6]naphthyridin-5,10-dion；Pyrido(2,3,4,5-lmn)phenanthridine-5,10-dione, 2,7-diamino-4,9-dihydro-；6,13-diamino-2,9-diazatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4(16),5,7,11(15),12-hexaene-3,10-dione
• CAS: 55621-48-2
• 化学式: C₁₄H₁₀N₄O₂
• 分子量: 266.259
• InChiKey: WFPZBRBDBWMNIF-UHFFFAOYSA-N

物化性质

• 熔点：
  >400 °C
• 沸点：
  447.1±45.0 °C(Predicted)
• 密度：
  1.593±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0
• 重原子数：
  20
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  110
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  copper dichloride 、 2,7-diamino-5,9-dihydro-dibenzo[de,ij][2,6]naphthyridine-5,10-dione 以 N,N-二甲基甲酰胺 为溶剂， 生成
  参考文献：
  名称：

  Copper(II), iron(III), and chromium(III) complexes with 5,10-dioxo-4,5,9,10-tetrahydro-4,9-diazapyrene derivatives

  摘要：

  Six copper(II), iron(III), and chromium(III) complexes with 5,10-dioxo-4,5,9,10-tetrahydro-4,9-diazapyrene derivatives (H(2)L(1)-H(2)L(3)) have been synthesized and studied by physical methods (IR and electronic absorption spectroscopy, quantum-chemical calculations). The composition of the complexes has been determined and their stability constants in aqueous dimethylformamide solutions have been calculated. The energy characteristics, electronic structure and geometry of isolated diazapyrenes and their tautomeric forms have been calculated by the PM6 method, and their complexes have been modeled.

  DOI：

  10.1134/s0036023610050098
• 作为产物：
  描述：

  4,4',6,6'-四硝基联苯甲酸 在 盐酸 、 溶剂黄146 、 tin(ll) chloride 作用下， 生成 2,7-diamino-5,9-dihydro-dibenzo[de,ij][2,6]naphthyridine-5,10-dione
  参考文献：
  名称：

  Christie; Kenner, Journal of the Chemical Society, 1926, p. 473

  摘要：

  DOI：

文献信息

• Christie; Kenner, Journal of the Chemical Society, 1926, p. 473
  作者：Christie、Kenner

  DOI：——

  日期：——
• MIGACHEV G. I.; ANDRIEVSKIJ A. M.; DOKUNIXIN N. S., ZH. ORGAN. XIMII, 1977, 13, HO 11, 2453
  作者：MIGACHEV G. I.、 ANDRIEVSKIJ A. M.、 DOKUNIXIN N. S.

  DOI：——

  日期：——
• Copper(II), iron(III), and chromium(III) complexes with 5,10-dioxo-4,5,9,10-tetrahydro-4,9-diazapyrene derivatives
  作者：O. V. Kovalchukova、O. A. Tsegel’nik、P. V. Strashnov、B. E. Zaitsev、S. B. Strashnova、O. V. Volyanski、K. E. Kobrakov

  DOI：10.1134/s0036023610050098

  日期：2010.5

  Six copper(II), iron(III), and chromium(III) complexes with 5,10-dioxo-4,5,9,10-tetrahydro-4,9-diazapyrene derivatives (H(2)L(1)-H(2)L(3)) have been synthesized and studied by physical methods (IR and electronic absorption spectroscopy, quantum-chemical calculations). The composition of the complexes has been determined and their stability constants in aqueous dimethylformamide solutions have been calculated. The energy characteristics, electronic structure and geometry of isolated diazapyrenes and their tautomeric forms have been calculated by the PM6 method, and their complexes have been modeled.
• MIGACHEV G. I.; TERENTEV A. M.; LISODED V. I., XIMIYA GETEROTSIKL. SOEDIN., 1979, HO 12, 1672-1677
  作者：MIGACHEV G. I.、 TERENTEV A. M.、 LISODED V. I.

  DOI：——

  日期：——