1-Methyl-2,3,5-tris(2,3,4-trimethoxyphenyl)pyrrole | 1314125-87-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 1-Methyl-2,3,5-tris(2,3,4-trimethoxyphenyl)pyrrole
• 英文别名: 1-methyl-2,3,5-tris(2,3,4-trimethoxyphenyl)pyrrole
• CAS: 1314125-87-5
• 化学式: C₃₂H₃₇NO₉
• 分子量: 579.647
• InChiKey: POAROPUSHCHWIU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  42
• 可旋转键数：
  12
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  88
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  N-甲基吡咯 在 potassium phosphate 、 N-溴代丁二酰亚胺(NBS) 、 palladium diacetate 、 三环己基膦 作用下， 以 四氢呋喃 、 1,4-二氧六环 、 甲苯 为溶剂， 反应 48.0h， 生成 1-Methyl-2,3,5-tris(2,3,4-trimethoxyphenyl)pyrrole
  参考文献：
  名称：

  Site-selective Suzuki–Miyaura reactions of 2,3,5-tribromo-N-methylpyrrole

  摘要：

  The first Suzuki-Miyaura reactions of 2,3,5-tribromo-N-methylpyrrole are reported. These reactions proceed with very good site-selectivity in favour of position 5 which is more reactive than position 2, due to steric reasons. The second attack occurs at position 2 which is more electron deficient than position 3. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.05.044

文献信息

• Site-selective Suzuki–Miyaura reactions of 2,3,5-tribromo-N-methylpyrrole
  作者：Serge-Mithérand Tengho Toguem、Olumide Fatunsin、Alexander Villinger、Peter Langer

  DOI：10.1016/j.tetlet.2011.05.044

  日期：2011.7

  The first Suzuki-Miyaura reactions of 2,3,5-tribromo-N-methylpyrrole are reported. These reactions proceed with very good site-selectivity in favour of position 5 which is more reactive than position 2, due to steric reasons. The second attack occurs at position 2 which is more electron deficient than position 3. (C) 2011 Elsevier Ltd. All rights reserved.