4-Fluorphenyl | 938082-78-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 4-Fluorphenyl
• 英文别名: N-[7-(pyridin-2-ylmethoxy)-1,8-naphthyridin-2-yl]acetamide
• CAS: 938082-78-1
• 化学式: C₁₆H₁₄N₄O₂
• 分子量: 294.313
• InChiKey: ICXQZILYRRPSPY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  77
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  4-Fluorphenyl 在 氢氧化钾 作用下， 以 甲醇 、 水 为溶剂， 以90%的产率得到7-(pyridin-2-ylmethoxy)-1,8-naphthyridin-2-amine
  参考文献：
  名称：

  A naphthyridine-based receptor for sensing citric acid

  摘要：

  A naphthyridine-based charge neutral receptor has been designed and synthesized. Its complexation with a series of carboxylic acids involved in the Krebs cycle has been studied by H-1 NMR, UV-vis and fluorescence methods. The receptor shows strong binding to citric acid (K-a = 1.60 x 10(5) M-1) and is also able to distinguish diastereomeric maleic acid from fumaric acid by fluorescence. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.02.047
• 作为产物：
  描述：

  2-吡啶甲醇 、 N-(7-氯-1,8-萘啶-2-基)乙酰胺 在 copper(I) oxide 、 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 以65%的产率得到4-Fluorphenyl
  参考文献：
  名称：

  A naphthyridine-based receptor for sensing citric acid

  摘要：

  A naphthyridine-based charge neutral receptor has been designed and synthesized. Its complexation with a series of carboxylic acids involved in the Krebs cycle has been studied by H-1 NMR, UV-vis and fluorescence methods. The receptor shows strong binding to citric acid (K-a = 1.60 x 10(5) M-1) and is also able to distinguish diastereomeric maleic acid from fumaric acid by fluorescence. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.02.047