1,3-Dimethyl-6-hydroxymethyl-5,6-dihydrouracil | 61755-90-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 1,3-Dimethyl-6-hydroxymethyl-5,6-dihydrouracil
• 英文别名: 6-hydroxymethyl-1,3-dimethyl-dihydro-pyrimidine-2,4-dione；2,4(1H,3H)-Pyrimidinedione, dihydro-6-(hydroxymethyl)-1,3-dimethyl-；6-(hydroxymethyl)-1,3-dimethyl-1,3-diazinane-2,4-dione
• CAS: 61755-90-6
• 化学式: C₇H₁₂N₂O₃
• 分子量: 172.184
• InChiKey: QQHGTSIFJPUNCZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.4
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  60.8
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1,3-二甲基脲嘧啶 生成 1,3-Dimethyl-6-hydroxymethyl-5,6-dihydrouracil
  参考文献：
  名称：

  ARYS, M.;CHRISTENSEN, T. B.;ERIKSEN, J., TETRAHEDRON LETT., 1984, 25, N 14, 1521-1524

  摘要：

  DOI：

文献信息

• Hydroxymethylation of 1,3-dimethyluracil and its derivatives induced by a photoredox system of Eu III /Eu II in MeOH
  作者：Akito Ishida、Susumu Toki、Setsuo Takamuku

  DOI：10.1039/c39850001481

  日期：——

  Irradiation of a methanol solution of EuCl3 and 1,3-dimethyluracil through a pyrex filter induced a regioselective hydroxymethylation with high efficiency, probably via an electron-transfer mechanism.

  通过派热克斯滤光片辐照EuCl 3和1,3-二甲基尿嘧啶的甲醇溶液可能通过电子转移机制高效诱导了区域选择性羟甲基化。
• Photochemistry of 1,3-dimethyluracil. A novel photochemical ring-opening leading to an enamine
  作者：Maria Arys、Torben B. Christensen、Jens Eriksen

  DOI：10.1016/s0040-4039(01)80202-1

  日期：——

  Besides known reduction and solvent addition products, the photolysis of 1,3-dimethyluracil in methanol resulted in formation of the enamine 2-methoxycarbonyl-N-methyl-3-methylaminopropenamide (5) a novel ring-opening reaction. A mechanism for the formation of 5 is suggested and its structure was confirmed by an independent synthesis.

  除了已知的还原和溶剂加成产物外，1,3-二甲基尿嘧啶在甲醇中的光解还导致烯胺2-甲氧基羰基-N-甲基-3-甲基氨基丙烯酰胺（5）的形成，这是一种新颖的开环反应。提出了形成5的机理，并通过独立的合成证实了其结构。
• Kristiansen, Marianne; Eriksen, Jens; Joergensen, Karl Anker, Journal of the Chemical Society. Perkin transactions I, 1990, # 1, p. 101 - 103
  作者：Kristiansen, Marianne、Eriksen, Jens、Joergensen, Karl Anker

  DOI：——

  日期：——
• ISHIDA, AKITO;TOKI, SUSUMU;TAKAMUKU, SETSUO, J. CHEM. SOC. CHEM. COMMUN., 1985, N 21, 1481-1483
  作者：ISHIDA, AKITO、TOKI, SUSUMU、TAKAMUKU, SETSUO

  DOI：——

  日期：——