diisoamyldibutylammonium bromide | 70742-17-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: diisoamyldibutylammonium bromide
• 英文别名: diisopentyldibutylammonium bromide；i-Am2Bu2NBr；(i-C5H11)2(C4H9)2NBr；dibutyl-bis(3-methylbutyl)azanium;bromide
• CAS: 70742-17-5
• 化学式: Br*C₁₈H₄₀N
• 分子量: 350.426
• InChiKey: BSRKLFFNGOUEEJ-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  20
• 可旋转键数：
  12
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  diisoamyldibutylammonium bromide 在 silver(l) oxide 作用下， 生成 diisopentyldibutylammonium hydroxide
  参考文献：
  名称：

  Clathrate formation in the series of systems diisopentyldibutylammonium halide-water

  摘要：

  Three clathrate hydrates: (i-C5H11)(2)center dot(C4H9)(2)NCl center dot 38H(2)O (mp 20.5 degrees C), (i-C5H11)(2)center dot(C4H9)(2)NCl center dot 32H(2)O (mp 22.2 degrees C), and (i-C5H11)(2)center dot(C4H9)(2)NCl center dot 27H(2)O (mp 23.8 degrees C) were detected in the system diisopentyldibutyl-ammonium chloride-water. Crystals of all the compounds were isolated, and their composition was determined. The size effect of the halide anions (F-, Cl-, and Br-) on the properties of related compounds was considered.

  DOI：

  10.1134/s1070363208080021
• 作为产物：
  描述：

  1-溴代异戊烷 在 铜 作用下， 以 乙腈 为溶剂， 反应 127.0h， 生成 diisoamyldibutylammonium bromide
  参考文献：
  名称：

  摘要：

  In the system i-Am2Bu2NBr-H2O, along with the known compound i-Am2Bu2NBr.38H(2)O, three new clathrate hydrates were revealed: i-Am2Bu2NBr.32H(2)O, i-Am2Bu2NBr.26H(2)O, and i-Am2Bu2NBr.24H(2)O. Crystals of all the hydrates were isolated, and their compositions and melting points were determined.

  DOI：

  10.1023/a:1015479214335