dibutyl 3-(N,N-dimethylamino)propyl phosphate

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: dibutyl 3-(N,N-dimethylamino)propyl phosphate
• 英文别名: (BuO)2P(O)OCH2CH2CH2NMe2；3-[dibutoxy(oxido)phosphaniumyl]oxy-N,N-dimethylpropan-1-amine
• 化学式: C₁₃H₃₀NO₄P
• 分子量: 295.359
• InChiKey: GKEPJPANDKNHKD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  19
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  54
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  dimethylazetidinium dibutylphosphate 以 氘代氯仿 为溶剂， 反应 0.5h， 生成 dibutyl 3-(N,N-dimethylamino)propyl phosphate
  参考文献：
  名称：

  Covalent Modification of DNA with Azetidinium Lipids

  摘要：

  我们研究了磷酸盐和氮杂环丁烷离子复合物共价键的形成，并将该反应应用于制备 DNA，该 DNA 是用氮杂环丁烷脂质在磷酸盐单元上精心制作的。

  DOI：

  10.1246/cl.2010.84

文献信息

• Synthesis, acid-base properties, and interphase distribution of new aminoalkylphosphates and -phosphonates
  作者：R. A. Cherkasov、A. R. Garifzyanov、N. S. Krasnova、M. V. Kazanova、A. V. Tarasov

  DOI：10.1134/s1070363208110078

  日期：2008.11

  Using the Todd-Atherton reaction, we synthesized new omega-aminoalkylphosphates differing by location of phosphate amino group in the molecule. For these compounds and for alpha-, beta-, and gamma-amino-phosphonates of similar structure ionization constants of phosphate and phosphonate groups were determined which turned out to be similar. In all the cases the increase in basicity of amine centers was shown with the growing distance between them and the phosphorus-containing substituent. By the method of two-phase potentiometric titration the constants of partition between water and a series of organic solvents were measured. The data obtained are interpreted in the framework of additive Leo-Hansch model that allows estimation of the increments of phosphate and amidophosphate groups. These data can be applied to the study of biological activity and extraction properties of the compound of such class.
• Covalent Modification of DNA with Azetidinium Lipids
  作者：Yusuke Yonamine、Takayoshi Kawasaki、Yoshio Okahata

  DOI：10.1246/cl.2010.84

  日期：2010.2.5

  We studied covalent bond formation of an ion complex of phosphate and azetidinium and applied the reaction to preparation of DNA which was elaborated at the phosphate units with azetidinium lipids.

  我们研究了磷酸盐和氮杂环丁烷离子复合物共价键的形成，并将该反应应用于制备 DNA，该 DNA 是用氮杂环丁烷脂质在磷酸盐单元上精心制作的。