6-butoxy-3,7-dimethyl-8-methoxyisochroman

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: 6-butoxy-3,7-dimethyl-8-methoxyisochroman
• 英文别名: 6-butoxy-8-methoxy-3,7-dimethyl-3,4-dihydro-1H-isochromene
• 化学式: C₁₆H₂₄O₃
• 分子量: 264.365
• InChiKey: AETNKIVCHWUOIQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  19
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  27.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-[3,5-dimethoxy-4-methylphenyl]-propan-2-ol 在 sodium hydride 、 乙硫醇 作用下， 以 四氢呋喃 为溶剂， 反应 11.75h， 生成 6-butoxy-3,7-dimethyl-8-methoxyisochroman
  参考文献：
  名称：

  Syntheses of 3,7-Dimethyl-8-hydroxy-6-methoxyisochroman, the 3,7-Dimethyl-6-hydroxy-8-methoxy Isomer, and Their Ester and Ether Derivatives:  Plant Growth Regulatory Activity

  摘要：

  A systematic investigation of ester and ether derivatives of 3,7-dimethyl-8-hydroxy-6-methoxyisochroman and 3,7-dimethyl-6-hydroxy-8-methoxyisochroman has established that all of the derivatives synthesized exhibited activity in the wheat coleoptile assay, with several of the compounds being more active than the parent systems.

  DOI：

  10.1021/jf960618l

文献信息

• US5922889A
  申请人：——

  公开号：US5922889A

  公开（公告）日：1999-07-13
• Syntheses of 3,7-Dimethyl-8-hydroxy-6-methoxyisochroman, the 3,7-Dimethyl-6-hydroxy-8-methoxy Isomer, and Their Ester and Ether Derivatives:  Plant Growth Regulatory Activity
  作者：Horace G. Cutler、George Majetich、Xinrong Tian、Paul Spearing

  DOI：10.1021/jf960618l

  日期：1997.4.1

  A systematic investigation of ester and ether derivatives of 3,7-dimethyl-8-hydroxy-6-methoxyisochroman and 3,7-dimethyl-6-hydroxy-8-methoxyisochroman has established that all of the derivatives synthesized exhibited activity in the wheat coleoptile assay, with several of the compounds being more active than the parent systems.