1-[3,5-dimethoxy-4-methylphenyl]-propan-2-ol | 187104-45-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-[3,5-dimethoxy-4-methylphenyl]-propan-2-ol
• 英文别名: 1-(3,5-Dimethoxy-4-methylphenyl)propan-2-ol
• CAS: 187104-45-6
• 化学式: C₁₂H₁₈O₃
• 分子量: 210.273
• InChiKey: CHNKMXDXXLFZQX-UHFFFAOYSA-N

物化性质

• 沸点：
  320.1±37.0 °C(Predicted)
• 密度：
  1.046±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  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 3,7-dimethyl-6-hexanoxy-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
• 作为产物：
  描述：

  3,5-dimethoxy-4-methylbenzyl alcohol 在 sodium tetrahydroborate 、 copper(l) iodide 、 mercury(II) diacetate 、 三溴化磷 作用下， 以 乙醚 为溶剂， 反应 5.33h， 生成 1-[3,5-dimethoxy-4-methylphenyl]-propan-2-ol
  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

• Synthesis of isochromans and their derivatives
  申请人：The United States od America as Represented by the Secretary of

  公开号：US05922889A1

  公开（公告）日：1999-07-13

  Isochromans and their derivatives have been chemically synthesized. These compounds possess significant phytotoxic activity which may be used as a biodegradable contact herbicide. The synthetic method allows for economic production of these herbicides.

  异色满和它们的衍生物已经被化学合成。这些化合物具有显著的植物毒性活性，可用作可生物降解的接触除草剂。合成方法允许经济生产这些除草剂。
• NOVEL 1-PHENYLMONO- OR -POLYHYDROXYPROPANE COMPOUNDS, COMPOSITIONS AND COSMETIC USES THEREOF
  申请人：L'OREAL

  公开号：US20170360665A1

  公开（公告）日：2017-12-21

  The present invention relates to novel compounds of formula (I) to compositions comprising same, and also to the use thereof for preventing and/or cosmetically treating the signs of aging of the skin.
• 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.