5-bromo-1-O-methyl-3-n-pentylcatechol

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 5-bromo-1-O-methyl-3-n-pentylcatechol
• 英文别名: 4-Bromo-2-methoxy-6-pentylphenol；4-bromo-2-methoxy-6-pentylphenol
• 化学式: C₁₂H₁₇BrO₂
• 分子量: 273.17
• InChiKey: LHOUTTXYTSKUJU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  15
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-甲氧基-6-戊基苯酚 在 溴 作用下， 以 二氯甲烷 为溶剂， 生成 5-bromo-1-O-methyl-3-n-pentylcatechol 、 4-bromo-1-O-methyl-3-n-pentylcatechol
  参考文献：
  名称：

  Regioselective bromination of O-β-glycosylated aromatics

  摘要：

  The quasi quantitative and regioselective bromination of O-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl) phenols is described. The orientating effect of the glycoside group is compared with those of other oxygenated groups and its usefulness illustrated with examples. These bromo-glycoslyated aromatics are able to react with alkenes via a Heck reaction and could be used for the synthesis of natural products.

  DOI：

  10.1016/0040-4039(95)00050-m

文献信息

• SUBSTITUTED 2,3-DIHYDROBENZOFURANYL COMPOUNDS AND USES THEREOF
  申请人：Karyopharm Therapeutics, Inc.

  公开号：EP2925750A1

  公开（公告）日：2015-10-07
• [EN] SUBSTITUTED 2,3-DIHYDROBENZOFURANYL COMPOUNDS AND USES THEREOF<br/>[FR] COMPOSÉS 2,3-DIHYDROBENZOFURANYLE SUBSTITUÉS ET LEURS UTILISATIONS
  申请人：KARYOPHARM THERAPEUTICS INC

  公开号：WO2014085607A1

  公开（公告）日：2014-06-05

  The invention generally relates to substituted 2,3-dihydrobenzofuranyl compounds, and more particularly to a compound represented by Structural Formula (I), or a pharmaceutically acceptable salt thereof, wherein the variables are as defined and described herein. The invention also includes the synthesis and use of a compound of Structural Formula (I), or a pharmaceutically acceptable salt or composition thereof, e.g., in the treatment of cancer (e.g., mantle cell lymphoma), and other diseases and disorders.
• Regioselective bromination of O-β-glycosylated aromatics
  作者：Stéphane Mabic、Jean-Pierre Lepoittevin

  DOI：10.1016/0040-4039(95)00050-m

  日期：1995.3

  The quasi quantitative and regioselective bromination of O-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl) phenols is described. The orientating effect of the glycoside group is compared with those of other oxygenated groups and its usefulness illustrated with examples. These bromo-glycoslyated aromatics are able to react with alkenes via a Heck reaction and could be used for the synthesis of natural products.