1-[2-Hydroxy-5-(3-thienyl)phenyl]ethanone | 893739-86-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-[2-Hydroxy-5-(3-thienyl)phenyl]ethanone
• 英文别名: 1-(2-hydroxy-5-thiophen-3-ylphenyl)ethanone
• CAS: 893739-86-1
• 化学式: C₁₂H₁₀O₂S
• 分子量: 218.276
• InChiKey: MOBHCUUHMUEXHQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  65.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-[2-Hydroxy-5-(3-thienyl)phenyl]ethanone 在 Selectfluor 作用下， 以 环己烷 、 甲苯 为溶剂， 反应 3.0h， 生成 2-(dimethylamino)-3,3-difluoro-6-(thiophen-3-yl)chroman-4-one
  参考文献：
  名称：

  Expedient chemoselective and catalyst-free synthesis of 3,3-difluorochroman-4-ones from o-hydroxyarylenaminones and Selectfluor

  摘要：

  An expedient and mild strategy for the synthesis of unconventional 2-(dimethylamino)-3,3-difluorochroman-4-one derivatives from o-hydroxyarylenaminones and Selectfluor was developed at room temperature under catalyst-free conditions. This method showed excellent chemoselectivity and great functional groups tolerance. (C) 2017 Chinese Chemical Society and Institute of Materia Medica, Chinese Academy of Medical Sciences. Published by Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.cclet.2017.10.027

文献信息

• Expedient chemoselective and catalyst-free synthesis of 3,3-difluorochroman-4-ones from o-hydroxyarylenaminones and Selectfluor
  作者：Jian Xu、Zhijie Kuang、Qiuling Song

  DOI：10.1016/j.cclet.2017.10.027

  日期：2018.6

  An expedient and mild strategy for the synthesis of unconventional 2-(dimethylamino)-3,3-difluorochroman-4-one derivatives from o-hydroxyarylenaminones and Selectfluor was developed at room temperature under catalyst-free conditions. This method showed excellent chemoselectivity and great functional groups tolerance. (C) 2017 Chinese Chemical Society and Institute of Materia Medica, Chinese Academy of Medical Sciences. Published by Elsevier B.V. All rights reserved.