ethyl 1,2,3,4-tetrahydro-4-ferrocenyl-(1-methoxymethyl)-6-methyl-2-oxopyrimidine-5-carboxylate | 1194506-81-4

• 英文名称: ethyl 1,2,3,4-tetrahydro-4-ferrocenyl-(1-methoxymethyl)-6-methyl-2-oxopyrimidine-5-carboxylate
• CAS: 1194506-81-4
• 化学式: C₂₀H₂₄FeN₂O₄
• 分子量: 412.269
• InChiKey: WTLLKAVRRFNCHV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  甲醇 、 ethyl 1,2,3,4-tetrahydro-4-ferrocenyl-6-methyl-2-oxopyrimidine-5-carboxylate 在 四丁基氢氧化铵 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 以85%的产率得到ethyl 1,2,3,4-tetrahydro-4-ferrocenyl-(1-methoxymethyl)-6-methyl-2-oxopyrimidine-5-carboxylate
  参考文献：
  名称：

  Application of Biginelli reaction to the synthesis of ferrocenylpyrimidones and [3]-ferrocenophane-containing pyrimido[4,5-d]pyrimidinediones

  摘要：

  A series of ferrocene-containing mono- and bis-dihydropyrimidines (DHP's) were prepared by boric acid mediated three-component Biginelli reactions of formyl- and 1,1'-diformylferrocene, 1,3-dioxo-components and urea. A few further transformations including hydrogenolysis of a benzyl 4-ferrocenyl-DHP-5-carboxylate were also performed. Novel cis-fused saturated pyrimido[4,5-d]pyrimidine-2,7(1H, 3H)-diones incorporating [3]-ferrocenophane moiety were constructed by means of iron(III)-catalyzed Biginelli-like condensations of 1,1'-diformylferrocene with urea and in situ generated methyl ketone-derived silyl enol ethers. The structures of the new compounds were established by IR and NMR spectroscopy, including HMQC, HMBC and DEPT measurements. (C) 2009 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2009.06.017