3-Hexyl-4,5-dihydro-isoxazole-5-carboxylic acid | 203392-16-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑啉类
• 英文名称: 3-Hexyl-4,5-dihydro-isoxazole-5-carboxylic acid
• 英文别名: 3-Hexyl-4,5-dihydro-1,2-oxazole-5-carboxylic acid
• CAS: 203392-16-9
• 化学式: C₁₀H₁₇NO₃
• 分子量: 199.25
• InChiKey: IXDBCQSGQBVBQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  58.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  正庚醛肟 、 丙烯酸 生成 3-Hexyl-4,5-dihydro-isoxazole-5-carboxylic acid
  参考文献：
  名称：

  Solid-phase synthesis of Δ2-isoxazolines

  摘要：

  Solid-phase synthesis of Delta(2)-isoxazolines through a 1,3-dipolar cycloaddition of nitrile oxides is described. The aldoxime is oxidized with commercially available bleach to give the corresponding nitrile oxide, which reacts in situ with dipolarophiles to afford Delta(2)-isoxazolines in good yields. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(97)10700-6

文献信息

• Solid-phase synthesis of Δ2-isoxazolines
  作者：Jie-Fei Cheng、Adnan M.M. Mjalli

  DOI：10.1016/s0040-4039(97)10700-6

  日期：1998.2

  Solid-phase synthesis of Delta(2)-isoxazolines through a 1,3-dipolar cycloaddition of nitrile oxides is described. The aldoxime is oxidized with commercially available bleach to give the corresponding nitrile oxide, which reacts in situ with dipolarophiles to afford Delta(2)-isoxazolines in good yields. (C) 1998 Elsevier Science Ltd. All rights reserved.