β-acetamido-β-(2-bromophenyl)-4-methoxypropiophenone | 1186585-91-0

• 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: β-acetamido-β-(2-bromophenyl)-4-methoxypropiophenone
• 英文别名: N-[1-(2-bromophenyl)-3-(4-methoxyphenyl)-3-oxopropyl]acetamide
• CAS: 1186585-91-0
• 化学式: C₁₈H₁₈BrNO₃
• 分子量: 376.25
• InChiKey: IXWWVRDBKQJIPC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  55.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  邻溴苯甲醛 、 乙腈 、 对甲氧基苯乙酮 在 Selectfluor 、 乙酰氯 、 水 作用下， 以90%的产率得到β-acetamido-β-(2-bromophenyl)-4-methoxypropiophenone
  参考文献：
  名称：

  An efficient green MCR protocol for the stereoselective synthesis of β-acetamido ketones catalyzed by Selectfluor™

  摘要：

  An efficient, green, room temperature process for the stereoselective synthesis of beta-amido ketones employing a one-pot multi-component reaction of aromatic aldehydes, alpha-substituted or alpha-unsubstituted ketones, an acid chloride, and a nitrile in presence of catalytic amount of Selectfluor (TM) is described. The process offers advantages such as high anti-selectivity, shorter reaction time, energy efficiency, and simple work-up. (c) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.06.022

文献信息

• An efficient green MCR protocol for the stereoselective synthesis of β-acetamido ketones catalyzed by Selectfluor™
  作者：V.S. Shinu、B. Sheeja、E. Purushothaman、D. Bahulayan

  DOI：10.1016/j.tetlet.2009.06.022

  日期：2009.8

  An efficient, green, room temperature process for the stereoselective synthesis of beta-amido ketones employing a one-pot multi-component reaction of aromatic aldehydes, alpha-substituted or alpha-unsubstituted ketones, an acid chloride, and a nitrile in presence of catalytic amount of Selectfluor (TM) is described. The process offers advantages such as high anti-selectivity, shorter reaction time, energy efficiency, and simple work-up. (c) 2009 Elsevier Ltd. All rights reserved.