1,8-bis[5-methoxy-2-(methoxymethoxy)phenyl]octane-1,8-diol | 200863-76-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1,8-bis[5-methoxy-2-(methoxymethoxy)phenyl]octane-1,8-diol
• CAS: 200863-76-9
• 化学式: C₂₆H₃₈O₈
• 分子量: 478.583
• InChiKey: PGMGQNMIPOWMMQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.78
• 重原子数：
  34.0
• 可旋转键数：
  17.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  95.84
• 氢给体数：
  2.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  1,8-bis[5-methoxy-2-(methoxymethoxy)phenyl]octane-1,8-diol 在 sodium acetate 、 lithium perchlorate 、 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 5.0h， 生成 2,2'-(2,4,13,15-tetraoxahexadecane-5,12-diyl)bis(4,4-dimethoxycyclohexa-2,5-dien-1-one)
  参考文献：
  名称：

  The synthesis of bisanthraquinone derivatives as DNA bisintercalating agents

  摘要：

  The linked bisanthraquinone derivatives 4a-c were synthesized as DNA bisintercalating agents. Starting from the aldehyde 7, the linking chain was introduced via a Grignard reaction to afford the ethers 9a-c. Subsequent anodic oxidation of these products, followed by annelation with the anion of phthalide 5 affordedthe linked anthraquinones 12. The target compounds were then obtained by selective esterification with the acid 14, followed by deprotection with anhydrous hydrogen chloride. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(97)10196-x
• 作为产物：
  描述：

  2-羟基-5-甲氧基苯甲醛 在 碘 、 magnesium 、 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 8.5h， 生成 1,8-bis[5-methoxy-2-(methoxymethoxy)phenyl]octane-1,8-diol
  参考文献：
  名称：

  The synthesis of bisanthraquinone derivatives as DNA bisintercalating agents

  摘要：

  The linked bisanthraquinone derivatives 4a-c were synthesized as DNA bisintercalating agents. Starting from the aldehyde 7, the linking chain was introduced via a Grignard reaction to afford the ethers 9a-c. Subsequent anodic oxidation of these products, followed by annelation with the anion of phthalide 5 affordedthe linked anthraquinones 12. The target compounds were then obtained by selective esterification with the acid 14, followed by deprotection with anhydrous hydrogen chloride. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(97)10196-x