Diethyl 5-propan-2-yl-1,2,4-triazine-3,6-dicarboxylate | 479081-51-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: Diethyl 5-propan-2-yl-1,2,4-triazine-3,6-dicarboxylate
• CAS: 479081-51-1
• 化学式: C₁₂H₁₇N₃O₄
• 分子量: 267.285
• InChiKey: FVGXGAIVLITZKM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  19
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  91.3
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  2,5-降冰片二烯 、 Diethyl 5-propan-2-yl-1,2,4-triazine-3,6-dicarboxylate 以 乙醇 为溶剂， 生成 diethyl 6-isopropylpyridine-2,5-dicarboxylate
  参考文献：
  名称：

  Synthesis of pyridine derivatives using aza Diels–Alder methodology

  摘要：

  Amidrazone 1 reacted with the unsymmetrical tricarbonyls 2a, 2c and 2d giving triazines 3a, 3c and 3d, respectively. These triazines were converted into their corresponding pyridine derivatives 6a, 6c and 6d in aza Diels-Alder reactions with 2,5-norbornadiene 5. Triazines 3e and 3d gave the pyridolactones 9c and 9d with 2,3-dihydrofuran. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)01215-7
• 作为产物：
  描述：

  乙基(2Z)-2-氨基-2-亚肼基-乙酸酯 、 4-methyl-2,3-dioxo-pentanoic acid ethyl ester 以 乙醇 为溶剂， 生成 Diethyl 5-propan-2-yl-1,2,4-triazine-3,6-dicarboxylate
  参考文献：
  名称：

  Synthesis of pyridine derivatives using aza Diels–Alder methodology

  摘要：

  Amidrazone 1 reacted with the unsymmetrical tricarbonyls 2a, 2c and 2d giving triazines 3a, 3c and 3d, respectively. These triazines were converted into their corresponding pyridine derivatives 6a, 6c and 6d in aza Diels-Alder reactions with 2,5-norbornadiene 5. Triazines 3e and 3d gave the pyridolactones 9c and 9d with 2,3-dihydrofuran. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)01215-7