(3-Decyloxy-5-hydroxymethyl-phenoxy)-acetic acid tert-butyl ester | 820958-38-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (3-Decyloxy-5-hydroxymethyl-phenoxy)-acetic acid tert-butyl ester
• 英文别名: Tert-butyl 2-[3-decoxy-5-(hydroxymethyl)phenoxy]acetate
• CAS: 820958-38-1
• 化学式: C₂₃H₃₈O₅
• 分子量: 394.552
• InChiKey: DMMNYAXGWSKUQF-UHFFFAOYSA-N

物化性质

• 沸点：
  505.4±40.0 °C(Predicted)
• 密度：
  1.022±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  28
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  65
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  (3-Decyloxy-5-hydroxymethyl-phenoxy)-acetic acid tert-butyl ester 在 N-溴代丁二酰亚胺(NBS) 、 三苯基膦 作用下， 以 四氢呋喃 为溶剂， 反应 0.02h， 以87%的产率得到Tert-butyl 2-[3-(bromomethyl)-5-decoxyphenoxy]acetate
  参考文献：
  名称：

  Dendrimers with Both Polar and Apolar Nanocontainer Characteristics

  摘要：

  Amphiphilic dendrimers with a custom-designed biaryl repeat unit have been synthesized. These dendrimers afford hydrophobic nanocontainers in polar solvents and hydrophilic nanocontainers in apolar solvents. These container properties were investigated using dye incorporation studies. The aggregation states of these dendrimers are also reported using DLS studies.

  DOI：

  10.1021/ja0449628
• 作为产物：
  描述：

  1-碘癸烷 在 18-冠醚-6 、 potassium carbonate 、 sodium iodide 作用下， 以 丙酮 、 乙腈 为溶剂， 反应 48.0h， 生成 (3-Decyloxy-5-hydroxymethyl-phenoxy)-acetic acid tert-butyl ester
  参考文献：
  名称：

  Dendrimers with Both Polar and Apolar Nanocontainer Characteristics

  摘要：

  Amphiphilic dendrimers with a custom-designed biaryl repeat unit have been synthesized. These dendrimers afford hydrophobic nanocontainers in polar solvents and hydrophilic nanocontainers in apolar solvents. These container properties were investigated using dye incorporation studies. The aggregation states of these dendrimers are also reported using DLS studies.

  DOI：

  10.1021/ja0449628

文献信息

• Invertible amphiphilic polymers
  申请人：Thayumanavan Sankaran

  公开号：US20070293669A1

  公开（公告）日：2007-12-20

  Amphiphilic monomeric compounds and corresponding homopolymers and copolymers capable of assembly and invertible configuration in introduction to and change in fluid medium.

  具有两性单体化合物及相应的同聚物和共聚物能够在流体介质中进行组装和可逆配置。
• US7687600B2
  申请人：——

  公开号：US7687600B2

  公开（公告）日：2010-03-30
• Homopolymer Micelles in Heterogeneous Solvent Mixtures
  作者：Subhadeep Basu、Dharma Rao Vutukuri、S. Thayumanavan

  DOI：10.1021/ja056042a

  日期：2005.12.1

  Amphiphilic homopolymers containing a hydrophilic and a hydrophobic functionality in each monomer unit have been shown to form polar or apolar containers depending on the solvent environment. When presented with a mixture of solvents, these polymeric containers are capable of releasing certain guest molecules. The fundamental mechanism behind these properties is investigated, and the utility of these assemblies in separations has been demonstrated with an example.
• Dendrimers with Both Polar and Apolar Nanocontainer Characteristics
  作者：Dharma Rao Vutukuri、Subhadeep Basu、S. Thayumanavan

  DOI：10.1021/ja0449628

  日期：2004.12.1

  Amphiphilic dendrimers with a custom-designed biaryl repeat unit have been synthesized. These dendrimers afford hydrophobic nanocontainers in polar solvents and hydrophilic nanocontainers in apolar solvents. These container properties were investigated using dye incorporation studies. The aggregation states of these dendrimers are also reported using DLS studies.