magnesium;29-phenyl-2,11,20,37,39-pentaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene | 125440-62-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: magnesium;29-phenyl-2,11,20,37,39-pentaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene
• CAS: 125440-62-2
• 化学式: C₃₉H₂₁MgN₇
• 分子量: 611.948
• InChiKey: XAVQYWVIMQCEOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.02
• 重原子数：
  47.0
• 可旋转键数：
  1.0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  92.65
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  magnesium;29-phenyl-2,11,20,37,39-pentaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene 在 硫酸 作用下， 反应 0.02h， 以98%的产率得到27-phenyl-29H,31H-tetrabenzo[b,g,l,q][5,10,15]-triazaporphyrin
  参考文献：
  名称：

  A novel synthetic approach to 27-aryltetrabenzo[5,10,15]triazaporphyrins

  摘要：

  Magnesium 27-aryltetrabenzo[5,10,15]triazaporphyrinates were obtained by heating of phthalodinitrile, arylacetonitrile and magnesium powder.

  DOI：

  10.1016/j.mencom.2011.03.011
• 作为产物：
  描述：

  苯乙腈 、 1,2-二氰基苯 在 magnesium 作用下， 反应 0.13h， 以11%的产率得到magnesium;29-phenyl-2,11,20,37,39-pentaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene
  参考文献：
  名称：

  A novel synthetic approach to 27-aryltetrabenzo[5,10,15]triazaporphyrins

  摘要：

  Magnesium 27-aryltetrabenzo[5,10,15]triazaporphyrinates were obtained by heating of phthalodinitrile, arylacetonitrile and magnesium powder.

  DOI：

  10.1016/j.mencom.2011.03.011

文献信息

• ——
  作者：N. E. Galanin、E. V. Kudrik、G. P. Shaposhnikov

  DOI：10.1023/a:1020918030094

  日期：——

  Magnesium complexes of highly soluble meso-phenyl-substituted tetrabenzoazaporphins were prepared from 1,3-diiminoisoindoline and phenylacetic acid in the presence of magnesium oxide. Some physicochemical and spectral properties of the compounds were investigated.
• LEZNOFF, CLIFFORD C.;MCKEOWN, NEIL B., J. ORG. CHEM., 55,(1990) N, C. 2186-2190
  作者：LEZNOFF, CLIFFORD C.、MCKEOWN, NEIL B.

  DOI：——

  日期：——