1-cyclohexyl-4,6-bis(4-methoxyphenyl)-2-pyridone | 1174004-85-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 1-cyclohexyl-4,6-bis(4-methoxyphenyl)-2-pyridone
• 英文别名: 1-Cyclohexyl-4,6-bis(4-methoxyphenyl)pyridin-2-one；1-cyclohexyl-4,6-bis(4-methoxyphenyl)pyridin-2-one
• CAS: 1174004-85-3
• 化学式: C₂₅H₂₇NO₃
• 分子量: 389.494
• InChiKey: UEAZJSAHXBHBHO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  29
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  38.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  环己基异氰酸酯 、 4-乙炔基苯甲醚 在 chlorobis(ethylene)rhodium(I) dimer 、 4,8-bis(1,1-tert-butyl)-Ν,Ν,1,2,10,11-hexamethyldibenzo[df][1,3,2]-2-dioxaphospho-6-amine 作用下， 以 甲苯 为溶剂， 以55%的产率得到1-cyclohexyl-4,6-bis(4-methoxyphenyl)-2-pyridone
  参考文献：
  名称：

  Regioselective rhodium-catalyzed intermolecular [2+2+2] cycloaddition of alkynes and isocyanates to form pyridones

  摘要：

  A highly regioselective rhodium-catalyzed intermolecular [2+2+2] cycloaddition of terminal alkynes with a variety of isocyanates to provide 2- and 4-pyridones has been developed. This reaction proceeds in good to excellent yields and overcomes the problem of dimerization and trimerization through the use of phosphoramidite ligands. A CO migration in the metallacycle is proposed to account for the formation of 4-pyridone. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.02.021

文献信息

• Regioselective rhodium-catalyzed intermolecular [2+2+2] cycloaddition of alkynes and isocyanates to form pyridones
  作者：Kevin M. Oberg、Ernest E. Lee、Tomislav Rovis

  DOI：10.1016/j.tet.2009.02.021

  日期：2009.6

  A highly regioselective rhodium-catalyzed intermolecular [2+2+2] cycloaddition of terminal alkynes with a variety of isocyanates to provide 2- and 4-pyridones has been developed. This reaction proceeds in good to excellent yields and overcomes the problem of dimerization and trimerization through the use of phosphoramidite ligands. A CO migration in the metallacycle is proposed to account for the formation of 4-pyridone. (C) 2009 Elsevier Ltd. All rights reserved.