5-Fluoro-1,3-bis(2-hydroxyethyl)-uracil | 55185-82-5

• 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: 5-Fluoro-1,3-bis(2-hydroxyethyl)-uracil
• 英文别名: 1,3-bis(2-hydroxyethyl)-5-fluorouracil；5-fluoro-1,3-bis(2-hydroxyethyl)pyrimidine-2,4-dione
• CAS: 55185-82-5
• 化学式: C₈H₁₁FN₂O₄
• 分子量: 218.185
• InChiKey: IMSLFZJVAPDMGY-UHFFFAOYSA-N

物化性质

• 沸点：
  364.8±52.0 °C(Predicted)
• 密度：
  1.52±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.7
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  81.1
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  在 二异丙胺 作用下， 以 甲醇 为溶剂， 反应 20.0h， 以90%的产率得到5-Fluoro-1,3-bis(2-hydroxyethyl)-uracil
  参考文献：
  名称：

  Sanyal, Utpal; Dutta, Sanghamitra; Banerjee, Sadhana, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1982, vol. 21, # 6, p. 565 - 569

  摘要：

  DOI：

文献信息

• Synthesis and cytotoxicity of novel fatty acid-nucleoside conjugates
  作者：Yun-Xiao Zhang、Gui-Fu Dai、Le Wang、Jing-Chao Tao

  DOI：10.1016/j.bmcl.2006.12.092

  日期：2007.3

  N3-Hydroxyethyltegafur (3) was synthesized in 91.0% yield under a new condition. A series of novel fatty acid esters of 3 were synthesized. These fatty acid-nucleoside conjugates have shown cytotoxicities against Ec9706 cells and A549 cells, and the structure activity relationship was discussed. (c) 2007 Elsevier Ltd. All rights reserved.
• Alkylation of pyrimidine derivatives with ethylene chlorohydrin
  作者：V. P. Krivonogov、V. A. Myshkin、G. G. Kozlova、Yu. N. Chernyshenko、A. I. Savlukov、V. V. Plechev、R. B. Ibatullina、I. B. Abdrakhmanov、L. V. Spirikhin

  DOI：10.1134/s1070428006110182

  日期：2006.11

  Alkylation of 6-methyluracil, 5-fluorouracil, uracil-5-ammonium sulfate, 5-hydroxyuracil, 5-hydroxy-6-methyluracil, 3,6-dimethyl-5-hydroxyuracil, and 1,3,6-trimethyl-5-hydroxyuracil with ethylene chlorohydrin in water-alcohol medium in the presence of KOH was investigated.
• Sanyal, Utpal; Dutta, Sanghamitra; Banerjee, Sadhana, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1982, vol. 21, # 6, p. 565 - 569
  作者：Sanyal, Utpal、Dutta, Sanghamitra、Banerjee, Sadhana、Chakraborti, S. K.

  DOI：——

  日期：——