3-fluoro-4,4-dimethoxytetrahydro-2H-pyran | 1149374-63-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-fluoro-4,4-dimethoxytetrahydro-2H-pyran
• CAS: 1149374-63-9
• 化学式: C₇H₁₃FO₃
• 分子量: 164.177
• InChiKey: IXEGOIDTPBSXLE-UHFFFAOYSA-N

物化性质

• 沸点：
  176.7±40.0 °C(Predicted)
• 密度：
  1.08±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.73
• 重原子数：
  11.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  27.69
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  3-fluoro-4,4-dimethoxytetrahydro-2H-pyran 在 盐酸 、 水 作用下， 以 甲醇 为溶剂， 生成 3-氟四氢吡喃-4-酮
  参考文献：
  名称：

  Design, synthesis, and structure–activity relationship of novel CCR2 antagonists

  摘要：

  A series of novel 1-aminocyclopentyl-3-carboxyamides incorporating substituted tetrahydropyran moieties have been synthesized and subsequently evaluated for their antagonistic activity against the human CCR2 receptor. Among them analog 59 was found to posses potent antagonistic activity. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2008.12.050
• 作为产物：
  描述：

  甲醇 、 5,6-二氢-4-甲氧基-2H-吡喃 在 Selectfluor 作用下， 以 乙腈 为溶剂， 生成 3-fluoro-4,4-dimethoxytetrahydro-2H-pyran
  参考文献：
  名称：

  Design, synthesis, and structure–activity relationship of novel CCR2 antagonists

  摘要：

  A series of novel 1-aminocyclopentyl-3-carboxyamides incorporating substituted tetrahydropyran moieties have been synthesized and subsequently evaluated for their antagonistic activity against the human CCR2 receptor. Among them analog 59 was found to posses potent antagonistic activity. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2008.12.050