1-[2,4-Dimethyl-5-[methyl-[methyl(1-prop-2-enoxybutan-2-yl)carbamoyl]amino]phenyl]-1,3-dimethyl-3-(1-prop-2-enoxybutan-2-yl)urea | 1234565-48-0

• 分子结构分类: 有机化合物 - 苯类化合物
• 英文名称: 1-[2,4-Dimethyl-5-[methyl-[methyl(1-prop-2-enoxybutan-2-yl)carbamoyl]amino]phenyl]-1,3-dimethyl-3-(1-prop-2-enoxybutan-2-yl)urea
• CAS: 1234565-48-0
• 化学式: C₂₈H₄₆N₄O₄
• 分子量: 502.698
• InChiKey: UFCDLTMZQYJDEW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  36
• 可旋转键数：
  14
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  65.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1-[2,4-Dimethyl-5-(1-prop-2-enoxybutan-2-ylcarbamoylamino)phenyl]-3-(1-prop-2-enoxybutan-2-yl)urea 、 碘甲烷 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 0.5h， 以54%的产率得到1-[2,4-Dimethyl-5-[methyl-[methyl(1-prop-2-enoxybutan-2-yl)carbamoyl]amino]phenyl]-1,3-dimethyl-3-(1-prop-2-enoxybutan-2-yl)urea
  参考文献：
  名称：

  Microporous polyacrylate matrix containing hydrogen bonded nanotubular assemblies

  摘要：

  We report the straightforward photo-polymerization of polyacrylate films containing bis-urea based self-assembled nanotubes. The obtained materials are characterized by gas adsorption measurements, 129Xe NMR spectroscopy and WAXS. The presence of the bis-ureas is shown by butane adsorption (at 273 K and ambient pressure) to be responsible for the formation of a significant microporosity. This porosity is however not detected by the classical argon adsorption procedure (at 77 K and low pressure). This effect is attributed to the contraction of the material at low temperature and pressure, and may be of general concern for other organic porous materials. One of the potential advantages of the present materials is that the porosity results from the self-assembled nanotubes and should therefore be independent of the matrix mechanical properties. It should in particular be possible to adjust the flexibility of the matrix by changing the monomer composition. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.polymer.2010.05.047