Methyl 2-(cyclohexylamino)-5-(4-methoxyphenyl)-4-methylbenzoate | 1383844-46-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Methyl 2-(cyclohexylamino)-5-(4-methoxyphenyl)-4-methylbenzoate
• 英文别名: methyl 2-(cyclohexylamino)-5-(4-methoxyphenyl)-4-methylbenzoate
• CAS: 1383844-46-9
• 化学式: C₂₂H₂₇NO₃
• 分子量: 353.461
• InChiKey: ZNJWWZPERVVBNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  47.6
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  环己胺 在 iron(III) chloride 、 copper diacetate 、 三氟乙酸 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 6.0h， 生成 methyl 3-(cyclohexylamino)-4'-methoxy-5-methyl-[1,1'-biphenyl]-2-carboxylate 、 Methyl 2-(cyclohexylamino)-5-(4-methoxyphenyl)-4-methylbenzoate
  参考文献：
  名称：

  Cu(OAc)₂/TFA-Promoted Formal [3 + 3] Cycloaddition/Oxidation of Enamines and Enones for Synthesis of Multisubstituted Aromatic Amines

  摘要：

  New strategies for the oxidative cycloaddition of enones with enamines are developed. These cycloaddition reactions directly afford substituted aromatic amines, which are important in organic chemistry, in moderate to good yield. Cu(OAc)(2)/TFA is shown to be essential to achieve high reaction efficiency.

  DOI：

  10.1021/ol3014733

文献信息

• Cu(OAc)₂/TFA-Promoted Formal [3 + 3] Cycloaddition/Oxidation of Enamines and Enones for Synthesis of Multisubstituted Aromatic Amines
  作者：Liang Li、Mi-Na Zhao、Zhi-Hui Ren、Jian-Li Li、Zheng-Hui Guan

  DOI：10.1021/ol3014733

  日期：2012.7.6

  New strategies for the oxidative cycloaddition of enones with enamines are developed. These cycloaddition reactions directly afford substituted aromatic amines, which are important in organic chemistry, in moderate to good yield. Cu(OAc)(2)/TFA is shown to be essential to achieve high reaction efficiency.