methyl 2-mesityl-4,6-dioxocyclohexanecarboxylate | 709643-00-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: methyl 2-mesityl-4,6-dioxocyclohexanecarboxylate
• 英文别名: 4-Methoxycarbonyl-5-(2,4,6-trimethylphenyl)-cyclohexane-1,3-dione；methyl 2,4-dioxo-6-(2,4,6-trimethylphenyl)cyclohexane-1-carboxylate
• CAS: 709643-00-5
• 化学式: C₁₇H₂₀O₄
• 分子量: 288.343
• InChiKey: HEOFRDHNXXHCFV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  60.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  乙酰香兰素 、 methyl 2-mesityl-4,6-dioxocyclohexanecarboxylate 、 2-萘胺 以 乙醇 为溶剂， 生成 methyl (9RS,10SR,12RS)-12-(4-acetoxy-3-methoxyphenyl)-9-mesityl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[a]acridine-10-carboxylate 、 methyl (9SR,10RS,12RS)-12-(4-acetoxy-3-methoxyphenyl)-9-mesityl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[a]acridine-10-carboxylate
  参考文献：
  名称：

  Synthesis of methyl 9-mesityl-12-aryl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[a]- acridine-10-carboxylates

  摘要：

  By condensation of 2-naphthylamine with methyl 2-mesityl-4,6-dioxocyclohexanecarboxylate and aromatic aldehydes new acridine derivatives were synthesized. The condensation in ethanol proceeded regiospecifi cally with moderate stereoselectivity resulting in a mixture of cis- and trans-methyl 9-mesityl-12-aryl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[a]acridine-10-carboxylate (similar to 40: 60%).

  DOI：

  10.1134/s1070428011110091

文献信息

• Synthesis of methyl 9-mesityl-12-aryl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[a]- acridine-10-carboxylates
  作者：N. G. Kozlov

  DOI：10.1134/s1070428011110091

  日期：2011.11

  By condensation of 2-naphthylamine with methyl 2-mesityl-4,6-dioxocyclohexanecarboxylate and aromatic aldehydes new acridine derivatives were synthesized. The condensation in ethanol proceeded regiospecifi cally with moderate stereoselectivity resulting in a mixture of cis- and trans-methyl 9-mesityl-12-aryl-11-oxo-7,8,9,10,11,12-hexahydrobenzo[a]acridine-10-carboxylate (similar to 40: 60%).