2,6-bis(N-tert-butylacetamide)pyridine-N-oxide | 906449-80-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2,6-bis(N-tert-butylacetamide)pyridine-N-oxide
• 英文别名: N-tert-butyl-2-[6-[2-(tert-butylamino)-2-oxoethyl]-1-oxidopyridin-1-ium-2-yl]acetamide
• CAS: 906449-80-7
• 化学式: C₁₇H₂₇N₃O₃
• 分子量: 321.42
• InChiKey: YGHVRSSOISSSRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  83.7
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  europium(III) nitrate hexahydrate 、 2,6-bis(N-tert-butylacetamide)pyridine-N-oxide 以 乙醇 为溶剂， 以95%的产率得到Eu(2,6-bis(N-tert-butylacetamide)pyridine-N-oxide)2(NO3)3(H2O)
  参考文献：
  名称：

  Synthesis and Lanthanide Coordination Properties of New 2,6-Bis(N-tert-butylacetamide)pyridine and 2,6-Bis(N-tert-butylacetamide)pyridine-N-oxide Ligands

  摘要：

  The compound 2,6-bis(N-tert-butylacetamide) pyridine ( 2) was obtained via a Ritter synthesis, and oxidation with oxone provided the title pyridine-N-oxide (3). The compounds were characterized by spectroscopic methods, and the molecular structure of the N-oxide was determined by single-crystal X-ray diffraction methods. The coordination chemistry with Eu(NO3)(3) was examined by using 1:1 and 2:1 ligand/Eu ratios, and a single-crystal X-ray analysis for Eu(3)(NO3)(3)(H2O) was completed. The ligand 3 is found to chelate in a tridentate fashion on the Eu(III).

  DOI：

  10.1021/ic060389c