2-氟-2-硝基-1-苯乙醇 | 38257-72-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 2-氟-2-硝基-1-苯乙醇
• 英文名称: 2-Fluoro-2-nitro-1-phenyl-ethanol
• 英文别名: Benzenemethanol, alpha-(fluoronitromethyl)-(9CI)；2-fluoro-2-nitro-1-phenylethanol
• CAS: 38257-72-6
• 化学式: C₈H₈FNO₃
• 分子量: 185.155
• InChiKey: CITFHQIDQZQOMU-UHFFFAOYSA-N

物化性质

• 沸点：
  313.3±42.0 °C(Predicted)
• 密度：
  1.330±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  66
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1-苯基-2-硝基乙醇 在 氢氧化钾 、 Selectfluor 作用下， 以 乙腈 、 水 为溶剂， 生成 2-氟-2-硝基-1-苯乙醇
  参考文献：
  名称：

  Convenient fluorination of nitro and nitrile compounds with Selectfluor

  摘要：

  A variety of nitro and nitrile compounds were fluorinated in good yields by Selectfluor under mild conditions. For these transformations to be successful, it is crucial to select proper amounts of an appropriate base as a function of the properties of the substrate and also to use Selectfluor only as required. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.05.056

文献信息

• Convenient fluorination of nitro and nitrile compounds with Selectfluor
  作者：Weimin Peng、Jean’ne M. Shreeve

  DOI：10.1016/j.tetlet.2005.05.056

  日期：2005.7

  A variety of nitro and nitrile compounds were fluorinated in good yields by Selectfluor under mild conditions. For these transformations to be successful, it is crucial to select proper amounts of an appropriate base as a function of the properties of the substrate and also to use Selectfluor only as required. (c) 2005 Elsevier Ltd. All rights reserved.