3-(2-hydroxyphenyl)-4,6-dimethoxyindole | 342808-86-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 3-(2-hydroxyphenyl)-4,6-dimethoxyindole
• 英文别名: 2-(4,6-dimethoxy-1H-indol-3-yl)phenol
• CAS: 342808-86-0
• 化学式: C₁₆H₁₅NO₃
• 分子量: 269.3
• InChiKey: BXFFNRFNMUBJHR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  54.5
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-(2-hydroxyphenyl)-4,6-dimethoxyindole 在 sodium tetrahydroborate 、 三氟乙酸 作用下， 以 甲醇 为溶剂， 反应 0.75h， 生成 2-(7-Hydroxymethyl-4,6-dimethoxy-1H-indol-3-yl)-phenol
  参考文献：
  名称：

  Synthesis of tethered indoles in the search for conformationally controlled calixindoles: an indole 3-substituent tether

  摘要：

  3-(2-Hydroxyphenyl)-4,6-dimethoxyindole 8 has been synthesised and linked to 1,3,5-tribromomethylbenzene and 1,2,4,5 tetrabromomethylbenzene to give the tri-indolyl and tetra-indolyl compounds 18 and 23, respectively. Attempts to generate capped calix[3]indoles and calix[4]indoles from these compounds were unsuccessful. (C) 2001 Elsevier Science Ltd. AU rights reserved.

  DOI：

  10.1016/s0040-4020(01)00053-9
• 作为产物：
  描述：

  N-acetyl-2-hydroxy-(3,5-dimethoxyanilino)-acetophenone 在 氢氧化钾 、 三氟乙酸 作用下， 以 甲醇 为溶剂， 反应 13.0h， 生成 3-(2-hydroxyphenyl)-4,6-dimethoxyindole
  参考文献：
  名称：

  Synthesis of tethered indoles in the search for conformationally controlled calixindoles: an indole 3-substituent tether

  摘要：

  3-(2-Hydroxyphenyl)-4,6-dimethoxyindole 8 has been synthesised and linked to 1,3,5-tribromomethylbenzene and 1,2,4,5 tetrabromomethylbenzene to give the tri-indolyl and tetra-indolyl compounds 18 and 23, respectively. Attempts to generate capped calix[3]indoles and calix[4]indoles from these compounds were unsuccessful. (C) 2001 Elsevier Science Ltd. AU rights reserved.

  DOI：

  10.1016/s0040-4020(01)00053-9

文献信息

• Synthesis of tethered indoles in the search for conformationally controlled calixindoles: an indole 3-substituent tether
  作者：David StC Black、Naresh Kumar、Darryl B McConnell

  DOI：10.1016/s0040-4020(01)00053-9

  日期：2001.3

  3-(2-Hydroxyphenyl)-4,6-dimethoxyindole 8 has been synthesised and linked to 1,3,5-tribromomethylbenzene and 1,2,4,5 tetrabromomethylbenzene to give the tri-indolyl and tetra-indolyl compounds 18 and 23, respectively. Attempts to generate capped calix[3]indoles and calix[4]indoles from these compounds were unsuccessful. (C) 2001 Elsevier Science Ltd. AU rights reserved.