5-乙酰基-2-溴苯并呋喃 | 1374787-46-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并呋喃
• 中文名称: 5-乙酰基-2-溴苯并呋喃
• 英文名称: 5-acetyl-2-bromobenzofuran
• 英文别名: 1-(2-Bromo-1-benzofuran-5-yl)ethanone；1-(2-bromo-1-benzofuran-5-yl)ethanone
• CAS: 1374787-46-8
• 化学式: C₁₀H₇BrO₂
• 分子量: 239.068
• InChiKey: XTPQXWQEZFMUOT-UHFFFAOYSA-N

物化性质

• 沸点：
  314.4±22.0 °C(Predicted)
• 密度：
  1.551±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  30.2
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  5-乙酰基-2-溴苯并呋喃 、 tris(4-chlorophenyl)bismuthane 在 palladium diacetate 、 caesium carbonate 、 三苯基膦 作用下， 以 N-甲基吡咯烷酮 为溶剂， 反应 1.0h， 以83%的产率得到5-acetyl-2-(4-chlorophenyl)benzofuran
  参考文献：
  名称：

  Palladium-catalyzed cross-couplings of functionalized 2-bromobenzofurans for atom-economic synthesis of 2-arylbenzofurans using triarylbismuth reagents

  摘要：

  The palladium catalyzed, atom-economic synthesis of various functionalized 2-arylbenzofurans was achieved through cross-coupling reaction of 2-bromobenzofurans with triarylbismuth reagents. The palladium catalytic protocol is very efficient to furnish various cross-coupled functionalized 2-arylbenzofurnas in high yields using triarylbismuth reagents with three aryl couplings as multi-coupling organometallic nucleophiles in one-pot operation. All the coupling reactions were completed in 1 h short reaction time involving three couplings from triarylbismuths under heating condition. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.03.059

文献信息

• Palladium-catalyzed cross-couplings of functionalized 2-bromobenzofurans for atom-economic synthesis of 2-arylbenzofurans using triarylbismuth reagents
  作者：Maddali L.N. Rao、Dheeraj K. Awasthi、Jalindar B. Talode

  DOI：10.1016/j.tetlet.2012.03.059

  日期：2012.5

  The palladium catalyzed, atom-economic synthesis of various functionalized 2-arylbenzofurans was achieved through cross-coupling reaction of 2-bromobenzofurans with triarylbismuth reagents. The palladium catalytic protocol is very efficient to furnish various cross-coupled functionalized 2-arylbenzofurnas in high yields using triarylbismuth reagents with three aryl couplings as multi-coupling organometallic nucleophiles in one-pot operation. All the coupling reactions were completed in 1 h short reaction time involving three couplings from triarylbismuths under heating condition. (C) 2012 Elsevier Ltd. All rights reserved.