Anethol-2-methylbutyrate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 英文名称: Anethol-2-methylbutyrate
• 英文别名: 4-(1-Propenyl)-phenyl-2-methyl butyrate；[4-[(E)-prop-1-enyl]phenyl] 2-methylbutanoate
• 化学式: C₁₄H₁₈O₂
• 分子量: 218.296
• InChiKey: QVAWDXCSFUFEAT-GQCTYLIASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-甲基丁酰氯 、 (E)-1-(4-hydroxyphenyl)propene 、 丙酰氯 、 异丁酰氯 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 (E)-4-(1-propen-1-yl)phenyl propionate 、 (E)-4-(1-propen-1-yl)phenyl isobutyrate 、 Anethol-2-methylbutyrate
  参考文献：
  名称：

  Bioactive Phenylpropanoids from Daucus crinitus Desf. from Algeria

  摘要：

  The volatile constituents of Daucus crinitus Desf. from Algeria were analyzed by GC and GC-MS, The main constituent was isochavicol isobutyrate (39.0%), an uncommon phenylpropanoid. By synthesis of a series of homologous esters, it was also possible to determine the presence of small amounts of isochavicol propionate, which has never been described previously as a natural product. The antibacterial and antifungal activities of the whole essential oil, of these two esters, and of isochavicol itself were investigated against a wide range of bacteria and fungi. Additionally, their antimalarial and antiradical properties were also evaluated, showing an interesting antiplasmodial activity of isochavicol.

  DOI：

  10.1021/jf903760b

文献信息

• Bioactive Phenylpropanoids from Daucus crinitus Desf. from Algeria
  作者：Don-Antoine Lanfranchi、Hocine Laouer、Meriem El Kolli、Soizic Prado、Christine Maulay-Bailly、Nicolas Baldovini

  DOI：10.1021/jf903760b

  日期：2010.2.24

  The volatile constituents of Daucus crinitus Desf. from Algeria were analyzed by GC and GC-MS, The main constituent was isochavicol isobutyrate (39.0%), an uncommon phenylpropanoid. By synthesis of a series of homologous esters, it was also possible to determine the presence of small amounts of isochavicol propionate, which has never been described previously as a natural product. The antibacterial and antifungal activities of the whole essential oil, of these two esters, and of isochavicol itself were investigated against a wide range of bacteria and fungi. Additionally, their antimalarial and antiradical properties were also evaluated, showing an interesting antiplasmodial activity of isochavicol.