1,4-bis(1-(2-methyl-1H-indol-3-yl)-2-nitroethyl) benzene | 1093405-04-9

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 1,4-bis(1-(2-methyl-1H-indol-3-yl)-2-nitroethyl) benzene
• 英文别名: 2-methyl-3-[1-[4-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenyl]-2-nitroethyl]-1H-indole
• CAS: 1093405-04-9
• 化学式: C₂₈H₂₆N₄O₄
• 分子量: 482.539
• InChiKey: NYQKQGHDJUQMRS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  36
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  123
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-甲基吲哚 、 1,4-bis(2-nitrovinyl)benzene 反应 13.0h， 以63%的产率得到1,4-bis(1-(2-methyl-1H-indol-3-yl)-2-nitroethyl) benzene
  参考文献：
  名称：

  Catalyst free conjugate addition of indoles and pyrroles to nitro alkenes under solvent free condition (SFC): an effective greener route to access 3-(2-nitro-1-phenylethyl)-1H-indole and 2-(2-nitro-1-phenylethyl)-1H-pyrrole derivatives

  摘要：

  Catalyst free conjugate addition of reactive hetero aromatics (pyrrole and indoles) to nitro alkenes under solvent free condition is described. This method provides several advantages, such as operational simplicity, solvent-free conditions and good yields of products. Also it is environmentally friendly and more cost effective alternative to existing protocols. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2010.05.104

文献信息

• Catalyst-free aqueous-mediated conjugative addition of indoles to β-nitrostyrenes
  作者：Pateliya Mujjamil Habib、Veerababurao Kavala、Chun-Wei Kuo、Ching-Fa Yao

  DOI：10.1016/j.tetlet.2008.09.109

  日期：2008.12

  A catalyst free aqueous-mediated alkylation of indoles with various beta-nitrostyrenes was performed at elevated temperature. No catalyst, clean reaction conditions, simple workup procedure, easy isolation, viability for large scale preparation, and environmentally acceptable medium are the best features in this process. (C) 2008 Elsevier Ltd. All rights reserved.