4-allyloxy-3-iodophenyl acetic acid | 207451-24-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 4-allyloxy-3-iodophenyl acetic acid
• 英文别名: 2-(3-Iodo-4-prop-2-enoxyphenyl)acetic acid
• CAS: 207451-24-9
• 化学式: C₁₁H₁₁IO₃
• 分子量: 318.111
• InChiKey: FXDAYXGEGOOEOE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  15
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-庚酮 、 4-allyloxy-3-iodophenyl acetic acid 在 4-二甲氨基吡啶 、 samarium diiodide 、 Tenta Gel S PHB resin 、 达卡巴嗪 、 三氟乙酸 作用下， 生成 2-[3-(2-Hydroxy-2-propylpentyl)-2,3-dihydro-1-benzofuran-5-yl]acetic acid
  参考文献：
  名称：

  SmI2-mediated sequential radical cyclization/anionic capture of aryl iodides on solid support

  摘要：

  Aryl radicals were generated by SmI2 on solid support, cyclized on to C=C bond, and reduced to their organosamarium anionic species followed by electrophilic capture. However, the capture reaction was substrate-dependant in solution and on solid support. In some examples, results from solid phase reactions were equal or better to the corresponding solution reactions. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)00292-5
• 作为产物：
  描述：

  2-(4-羟基-3-碘苯基)乙酸甲酯 在 lithium hydroxide 、 potassium carbonate 作用下， 以 四氢呋喃 、 水 、 N,N-二甲基甲酰胺 为溶剂， 生成 4-allyloxy-3-iodophenyl acetic acid
  参考文献：
  名称：

  SmI2-mediated sequential radical cyclization/anionic capture of aryl iodides on solid support

  摘要：

  Aryl radicals were generated by SmI2 on solid support, cyclized on to C=C bond, and reduced to their organosamarium anionic species followed by electrophilic capture. However, the capture reaction was substrate-dependant in solution and on solid support. In some examples, results from solid phase reactions were equal or better to the corresponding solution reactions. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)00292-5