21H,23H-四氮卟吩,2,3,7,8,12,13,17,18-八(4-硝基苯基)- | 167962-42-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 中文名称: 21H,23H-四氮卟吩,2,3,7,8,12,13,17,18-八(4-硝基苯基)-
• 英文名称: octa(p-nitrophenyl)tetraazaporphin
• 英文别名: octa(p-nitrophenyl)tetraazaporphyrin；4,5,9,10,14,15,19,20-Octakis(4-nitrophenyl)-2,7,12,17,21,22,23,24-octazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16(22),18(21),19-undecaene；4,5,9,10,14,15,19,20-octakis(4-nitrophenyl)-2,7,12,17,21,22,23,24-octazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16(22),18(21),19-undecaene
• CAS: 167962-42-7
• 化学式: C₆₄H₃₄N₁₆O₁₆
• 分子量: 1283.07
• InChiKey: QPVHTBHJMPCCLW-UHFFFAOYSA-N

物化性质

• 密度：
  1.602±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  12.5
• 重原子数：
  96
• 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：
  476
• 氢给体数：
  2
• 氢受体数：
  22

反应信息

• 作为反应物：
  描述：

  21H,23H-四氮卟吩,2,3,7,8,12,13,17,18-八(4-硝基苯基)- 在 palladium dichloride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 0.01h， 以93%的产率得到
  参考文献：
  名称：

  Synthesis of Palladium and Nickel Complexes with Octaphenyltetraazaporphyrins

  摘要：

  Palladium(II) and nickel(II) complexes with octaphenyltetraazaporphyrin, octakis(4-bromophenyl)tetraazaporphyrin, and octakis(4-nitrophenyl)tetraazaporphyrin were obtained by reactions of octaphenyltetraazaporphyrin, Mg octaphenyltetraazaporphyrin, octakis(4-bromophenyl)tetraazaporphyrin, and octakis(4-nitrophenyl)tetraazaporphyrin with palladium(II) and nickel(II) chlorides in DMF.

  DOI：

  10.1023/b:rugc.0000016039.52090.d2
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 sodium nitrite 作用下， 以 三氟乙酸 为溶剂， 反应 10.0h， 以50%的产率得到21H,23H-四氮卟吩,2,3,7,8,12,13,17,18-八(4-硝基苯基)-
  参考文献：
  名称：

  Chizhova, N. V.; Berezin, B. D., Russian Journal of Organic Chemistry, 1994, vol. 30, # 11, p. 1765 - 1767

  摘要：

  DOI：

文献信息

• Kinetic Regularities of Slow Proton Transfer from β-Substituted Porphyrazines to Organic Bases
  作者：O. A. Petrov

  DOI：10.1134/s003602442104021x

  日期：2021.4

  The regularities of intermolecular proton transfer from β-substituted porphyrazines to dimethylsulfoxide, cyclic and acyclic nitrogen-containing bases in inert solvents are considered. We found that the process rates are unusually low. We showed that the acidic properties of a porphyrazine macrocycle, the proton-acceptor ability of a base, and the dielectric constant of the environment influence the

  研究了惰性溶剂中β-取代四氮杂卟啉到二甲亚砜、环状和非环状含氮碱基的分子间质子转移规律。我们发现处理率异常低。我们表明，四氮杂卟啉大环化合物的酸性、碱的质子受体能力和环境的介电常数会影响酸碱相互作用的动力学参数。讨论了四氮杂卟啉质子转移配合物的结构和稳定性。
• Chizhova; Berezin, Russian Journal of Inorganic Chemistry, 2003, vol. 48, # 9, p. 1359 - 1363
  作者：Chizhova、Berezin

  DOI：——

  日期：——
• Synthesis and spectral properties of the Co2+ and Co3+ complexes with octaaryltetraazaporphyrins
  作者：N. V. Chizhova、O. G. Khelevina、R. S. Kumeev、B. D. Berezin、N. Zh. Mamardashvili

  DOI：10.1134/s1070363210110253

  日期：2010.11

  Complexes Co2+ and Co3+ with octaphenyltetraazaporphyrin, octa(4-bromphenyl)tetraazaporphyrin and octa(4-nitrophenyl)tetraazaporphyrin were obtained and identified. The influence of the composition of reaction medium on the oxidation processes of the complexes Co2+ -> Co3+ in DMF was revealed and the optimum conditions of formation of the corresponding compounds were determined.
• Acid-base interaction of octaaryltetraazaporphyrin complexes in a proton-donor medium
  作者：O. G. Khelevina、N. V. Chizhova、A. S. Malyasova、E. A. Kokareva

  DOI：10.1134/s1070363212040263

  日期：2012.4

  The processes of acid-base interactions of the octaaryltetraazaporphyrin complexes in a protondonor environment based on acetic or trifluoroacetic acids was studied. The constants of the acidity of the protonated forms were determined. The introduction of electron-withdrawing functional groups was shown to reduce the basicity of the meso-nitrogen atoms of the macrocycle. The decrease in the cobalt oxidation state was shown to reduce the complex basicity.
• Khelevina; Chizhova; Rumyantseva, Russian Journal of Coordination Chemistry, 1999, vol. 25, # 9, p. 634 - 637
  作者：Khelevina、Chizhova、Rumyantseva

  DOI：——

  日期：——