N'-(6-(2-(2-hydroxyethoxy)ethoxy)hexyl)-N,N-dimethylacetimidamide | 1268136-23-7

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N'-(6-(2-(2-hydroxyethoxy)ethoxy)hexyl)-N,N-dimethylacetimidamide
• 英文别名: N'-[6-[2-(2-hydroxyethoxy)ethoxy]hexyl]-N,N-dimethylethanimidamide
• CAS: 1268136-23-7
• 化学式: C₁₄H₃₀N₂O₃
• 分子量: 274.404
• InChiKey: GYESKIFRPCYTHX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  19
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  54.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  6-phthalimido-1-hexanol 在 4-二甲氨基吡啶 、 hydrazine hydrate 、 1-氨基癸烷 、 palladium 10% on activated carbon 、 氢气 、 sodium hydride 、 二甲胺 作用下， 以 四氢呋喃 、 乙醇 、 二氯甲烷 、 mineral oil 为溶剂， 反应 66.25h， 生成 N'-(6-(2-(2-hydroxyethoxy)ethoxy)hexyl)-N,N-dimethylacetimidamide
  参考文献：
  名称：

  A Synthesis of Acetamidines

  摘要：

  The condensation of primary amine with N,N-dimethylacetamide dimethyl acetal yields a mixture of acetamidine and imidate ester. The product distribution in this reaction depends on the temperature, solvent, and structure of the primary amine. It is possible to suppress the formation of imidate ester by performing the reaction in the presence of excess dimethyl amine, yielding acetamidine as the exclusive product. For acetamidines that cannot be purified either by crystallization or distillation, this new method is necessary for the generation of pure acetamidines in good yields.

  DOI：

  10.1021/jo102358d

文献信息

• A Synthesis of Acetamidines
  作者：Jitendra R. Harjani、Chen Liang、Philip G. Jessop

  DOI：10.1021/jo102358d

  日期：2011.3.18

  The condensation of primary amine with N,N-dimethylacetamide dimethyl acetal yields a mixture of acetamidine and imidate ester. The product distribution in this reaction depends on the temperature, solvent, and structure of the primary amine. It is possible to suppress the formation of imidate ester by performing the reaction in the presence of excess dimethyl amine, yielding acetamidine as the exclusive product. For acetamidines that cannot be purified either by crystallization or distillation, this new method is necessary for the generation of pure acetamidines in good yields.