2-(4-chlorobenzoyl)furan-3-carbonitrile

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-(4-chlorobenzoyl)furan-3-carbonitrile
• 英文别名: 2-(4-Chlorobenzoyl)furan-3-carbonitrile
• 化学式: C₁₂H₆ClNO₂
• 分子量: 231.638
• InChiKey: GBRYBVFPMHUBSU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  54
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  4-氯苯甲酰氯 、 3-呋喃甲睛 在 2,2,6,6-tetramethylpiperidinylmagnesium chloride lithium chloride complex 、 碘 、 zinc(II) chloride 、 四(三苯基膦)钯 作用下， 以 四氢呋喃 为溶剂， 反应 14.25h， 以85%的产率得到2-(4-chlorobenzoyl)furan-3-carbonitrile
  参考文献：
  名称：

  Directed Functionalization of Cyano-Substituted Furans and Thiophenes with TMPMgCl·LiCl

  摘要：

  A number of novel difunctionalized furans and thiophenes has been prepared by the reaction of the cyano-substituted substrates with TMPMgClLiCl followed by the reaction with electrophiles. The crucial metalation step takes place under mild conditions allowing the isolation of desired derivatives in reasonable to good yields.

  DOI：

  10.1055/s-0035-1560586

文献信息

• Directed Functionalization of Cyano-Substituted Furans and Thiophenes with TMPMgCl·LiCl
  作者：Giuliano Clososki、Fernanda dos Santos、João Batista、Ricardo Vessecchi

  DOI：10.1055/s-0035-1560586

  日期：——

  A number of novel difunctionalized furans and thiophenes has been prepared by the reaction of the cyano-substituted substrates with TMPMgClLiCl followed by the reaction with electrophiles. The crucial metalation step takes place under mild conditions allowing the isolation of desired derivatives in reasonable to good yields.