1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecaneopentyloxyphthalocyaninato manganese(III) acetate | 898232-78-5

• 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: 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecaneopentyloxyphthalocyaninato manganese(III) acetate
• 英文别名: NeoPc(2-)Mn(OAc)
• CAS: 898232-78-5
• 化学式: C₂H₃O₂*C₁₁₂H₁₇₆N₈O₁₆*Mn
• 分子量: 2004.66
• InChiKey: IBROIRYCMIBYTK-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  27.68
• 重原子数：
  141.0
• 可旋转键数：
  32.0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  293.35
• 氢给体数：
  0.0
• 氢受体数：
  24.0

反应信息

• 作为产物：
  描述：

  1, 2, 3, 4, 8, 9, 10,11, 15, 16, 17, 18, 22, 23, 24, 25-hexadecaneopentoxyphthalocyanine 、 manganese(II) acetate 以 N,N-二甲基甲酰胺 为溶剂， 以14%的产率得到1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecaneopentyloxyphthalocyaninato manganese(III) acetate
  参考文献：
  名称：

  Red manganese phthalocyanines from highly hindered hexadecaalkoxyphthalocyanines

  摘要：

  Highly hindered magnesium and metal-free green 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecaneopentoxyphthalocyanine and 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadeca(cyclohexylmethyloxy)phthalocyanine were prepared via magnesium 1-octanolate and 3,4,5,6-tetraneopenioxyphthalonitrile or 3,4,5,6-tetra(cyclohexylmethyloxy)phthalonitrile. Treatment of the metal-free phthalocyanine with Mn(OAc)(2) yielded deep red manganese(III) hexadecaalkoxy phthalocyanines. Electrochemical and spectroelectrochemical studies led to the characterization, in solution, of a series of species in a range of different manganese and phthalocyanine oxidation states. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2005.10.046