(2,4,9,11,16,18,23,25-octakis(diethylaminosulfonyl)phthalocyaninato)cobalt(II) | 944272-07-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: (2,4,9,11,16,18,23,25-octakis(diethylaminosulfonyl)phthalocyaninato)cobalt(II)
• 英文别名: cobalt(2+);5-N,5-N,7-N,7-N,14-N,14-N,16-N,16-N,23-N,23-N,25-N,25-N,32-N,32-N,34-N,34-N-hexadecaethyl-2,11,20,29,37,39-hexaza-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(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene-5,7,14,16,23,25,32,34-octasulfonamide
• CAS: 944272-07-5
• 化学式: C₆₄H₈₈CoN₁₆O₁₆S₈
• 分子量: 1653.02
• InChiKey: AVDUQRCVGIQQCU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.37
• 重原子数：
  105
• 可旋转键数：
  32
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  442
• 氢给体数：
  0
• 氢受体数：
  28

反应信息

• 作为产物：
  描述：

  [2,4,9,11,16,18,23,25-octakis(sulfonyl chloride)phthalocyaninato]cobalt(II) 、 二乙胺 以 丙酮 为溶剂， 生成 (2,4,9,11,16,18,23,25-octakis(diethylaminosulfonyl)phthalocyaninato)cobalt(II)
  参考文献：
  名称：

  Synthesis and properties of metal phthalocyanines based on disulfophthalic acid

  摘要：

  Octasulfo-substituted cobalt phthalocyaninate was synthesized from 3,5-disulfophthalic acid, and its ammonium salt was converted into the corresponding sulfonyl chloride by the action of chlorosulfonic acid. Treatment of the chlorosulfonyl-substituted phthalocyanine complex with aliphatic amines gave octaalkyl-sulfamoyl derivatives. The products were characterized by IR and electronic absorption spectra.

  DOI：

  10.1134/s1070363206080317