Methyl 4-[3-(4-methylphenyl)-3-oxoprop-1-enyl]benzoate

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: Methyl 4-[3-(4-methylphenyl)-3-oxoprop-1-enyl]benzoate
• 化学式: C₁₈H₁₆O₃
• 分子量: 280.323
• InChiKey: XXOOCJANIAKHNK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  重氮甲烷 、 4-(3-oxo-3-p-tolylpropenyl)benzoic acid 以 二氯甲烷 为溶剂， 反应 0.5h， 以35%的产率得到Methyl 4-[3-(4-methylphenyl)-3-oxoprop-1-enyl]benzoate
  参考文献：
  名称：

  Solid-Supported Cross-Metathesis and a Formal Alkane Metathesis for the Generation of Biologically Relevant Molecules

  摘要：

  Solid-phase synthetic strategies toward the generation of libraries of biologically relevant molecules were developed using olefin cross-metathesis as a key step. It is remarkably the formal alkane metathesis based on a one-pot, microwave-assisted, ruthenium-catalyzed cross-metathesis and reduction to obtain Csp3-Csp3 linkages.

  DOI：

  10.1021/co500176b

文献信息

• Solid-Supported Cross-Metathesis and a Formal Alkane Metathesis for the Generation of Biologically Relevant Molecules
  作者：Luciana Méndez、Ernesto G. Mata

  DOI：10.1021/co500176b

  日期：2015.2.9

  Solid-phase synthetic strategies toward the generation of libraries of biologically relevant molecules were developed using olefin cross-metathesis as a key step. It is remarkably the formal alkane metathesis based on a one-pot, microwave-assisted, ruthenium-catalyzed cross-metathesis and reduction to obtain Csp3-Csp3 linkages.