[4-(2-hydroxymethoxycarbonyl)phenyl]-4-hexadecyloxybenzoate

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 缩酚酸和缩酚酸环醚类
• 英文名称: [4-(2-hydroxymethoxycarbonyl)phenyl]-4-hexadecyloxybenzoate
• 英文别名: Methyl 4-(4-hexadecoxybenzoyl)oxy-2-hydroxybenzoate；methyl 4-(4-hexadecoxybenzoyl)oxy-2-hydroxybenzoate
• 化学式: C₃₁H₄₄O₆
• 分子量: 512.687
• InChiKey: JHYFVMJLZJPVNH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11
• 重原子数：
  37
• 可旋转键数：
  21
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  82.1
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  2,4-二羟基苯甲酸甲酯 、 4-十六烷氧基苯甲酸 在 4-二甲氨基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 氯仿 为溶剂， 反应 10.0h， 以81.2%的产率得到[4-(2-hydroxymethoxycarbonyl)phenyl]-4-hexadecyloxybenzoate
  参考文献：
  名称：

  Synthesis of Mesomorphic Derivatives of Methyl 2,4-Dihydroxybenzoate and Spectral and Luminescence Properties of Their Lanthanide Complexes

  摘要：

  The derivatives of methyl 2,4-dihydroxybenzoate containing fragments of different organic acids in position 4 have been synthesized. Their mesomorphic properties have been investigated. Lanthanide complexes of the prepared compounds have been obtained. Their spectral properties have been studied.

  DOI：

  10.1134/s1070363218120174

文献信息

• Synthesis of Mesomorphic Derivatives of Methyl 2,4-Dihydroxybenzoate and Spectral and Luminescence Properties of Their Lanthanide Complexes
  作者：N. S. Novikova、E. D. Kilimenchuk、R. V. Kondrat’eva、O. I. Teslyuk、I. I. Zheltvai

  DOI：10.1134/s1070363218120174

  日期：2018.12

  The derivatives of methyl 2,4-dihydroxybenzoate containing fragments of different organic acids in position 4 have been synthesized. Their mesomorphic properties have been investigated. Lanthanide complexes of the prepared compounds have been obtained. Their spectral properties have been studied.