ethyl 2-(3-cyanophenyl)furan-3-carboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃
• 英文名称: ethyl 2-(3-cyanophenyl)furan-3-carboxylate
• 英文别名: Ethyl 2-(3-cyanophenyl)furan-3-carboxylate
• 化学式: C₁₄H₁₁NO₃
• 分子量: 241.246
• InChiKey: OYPBUNYMHHJVSV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  63.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  乙基3-氟 、 间溴苯甲腈 在 四(三苯基膦)钯 potassium acetate 作用下， 以 甲苯 为溶剂， 以60%的产率得到ethyl 2-(3-cyanophenyl)furan-3-carboxylate
  参考文献：
  名称：

  Regioselective Palladium-Catalyzed Arylation of 3-Carboalkoxy Furan and Thiophene

  摘要：

  [GRAPHICS]The regioselective palladium(0)-catalyzed arylation of 3-furoate and 3-thiophenecarboxylate esters with aryl bromides is described. Conditions were developed that allow for the selective synthesis of either 2-aryl or 5-aryl products.

  DOI：

  10.1021/ol027266q

文献信息

• Regioselective Palladium-Catalyzed Arylation of 3-Carboalkoxy Furan and Thiophene
  作者：Bobby Glover、Kimberly A. Harvey、Bing Liu、Matthew J. Sharp、Maria F. Tymoschenko

  DOI：10.1021/ol027266q

  日期：2003.2.1

  [GRAPHICS]The regioselective palladium(0)-catalyzed arylation of 3-furoate and 3-thiophenecarboxylate esters with aryl bromides is described. Conditions were developed that allow for the selective synthesis of either 2-aryl or 5-aryl products.