| 1234793-77-1

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物
• CAS: 1234793-77-1
• 化学式: C₃₂H₃₈O₉
• 分子量: 566.648
• InChiKey: MAENXSJPASWGLF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.93
• 重原子数：
  41.0
• 可旋转键数：
  14.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  116.07
• 氢给体数：
  3.0
• 氢受体数：
  9.0

反应信息

• 作为反应物：
  描述：

  、 乙酸酐 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 以92%的产率得到
  参考文献：
  名称：

  Efficient construction of the core framework of lysidicin A via three Claisen rearrangements including a cascade reaction

  摘要：

  A model compound (6) with the core skeleton of lysidicin A was synthesized as a racemate. The key step (8,7) includes three Claisen rearrangements of the triether with phloroglucinols; two of which rearranged in a cascade manner and the other was a simple rearrangement. This one-pot reaction enabled the introduction of three phloroglucinol units at the correct positions and makes the synthetic approach significantly efficient. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.04.073
• 作为产物：
  描述：

  1-[2,5-Bis[(3,5-dimethoxyphenoxy)methyl]hexa-2,5-dienoxy]-3,5-dimethoxybenzene 在 水 、 三甲基铝 作用下， 以 二氯甲烷 为溶剂， 反应 4.0h， 以83%的产率得到
  参考文献：
  名称：

  Efficient construction of the core framework of lysidicin A via three Claisen rearrangements including a cascade reaction

  摘要：

  A model compound (6) with the core skeleton of lysidicin A was synthesized as a racemate. The key step (8,7) includes three Claisen rearrangements of the triether with phloroglucinols; two of which rearranged in a cascade manner and the other was a simple rearrangement. This one-pot reaction enabled the introduction of three phloroglucinol units at the correct positions and makes the synthetic approach significantly efficient. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.04.073