2,6-dimethylpyrimidin-4-yl diethyl phosphate | 99190-30-4

• 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: 2,6-dimethylpyrimidin-4-yl diethyl phosphate
• 英文别名: phosphoric acid diethyl ester-(2,6-dimethyl-pyrimidin-4-yl ester)；Phosphorsaeure-diaethylester-(2,6-dimethyl-pyrimidin-4-ylester)；(2,6-Dimethylpyrimidin-4-yl) diethyl phosphate；(2,6-dimethylpyrimidin-4-yl) diethyl phosphate
• CAS: 99190-30-4
• 化学式: C₁₀H₁₇N₂O₄P
• 分子量: 260.23
• InChiKey: XUTJLWYXMSRALI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  17
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  70.5
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2,6-dimethylpyrimidin-4-yl diethyl phosphate 、 环己基溴化镁 在 [1,6-bis(2-hydroxyphenyl)-2,5-diaza-hexa-1,5-diene]iron(III) chloride 作用下， 以 四氢呋喃 、 N-甲基吡咯烷酮 为溶剂， 以83%的产率得到4-cyclohexyl-2,6-dimethylpyrimidine
  参考文献：
  名称：

  Heteroaromatic Sulfonates and Phosphates as Electrophiles in Iron-Catalyzed Cross-Couplings

  摘要：

  Employment of heteroaromatic tosylates and phosphates as suitable electrophiles in iron-catalyzed cross-coupling reactions with alkyl Grignard reagents is reported. These reactions are performed at low temperature allowing good functional group tolerance and full conversion is achieved within minutes. In addition, an aryl-aryl cross-coupling utilizing a heteroaryl sulfamate electrophile is reported.

  DOI：

  10.1021/ol901975u
• 作为产物：
  描述：

  氯磷酸二乙酯 、 alkaline earth salt of/the/ methylsulfuric acid 在 甲苯 作用下， 生成 2,6-dimethylpyrimidin-4-yl diethyl phosphate
  参考文献：
  名称：

  Arbusow; Soroastrowa, Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1958, p. 1331,1337; engl. Ausg. S. 1284, 1289

  摘要：

  DOI：

文献信息

• Heteroaromatic Sulfonates and Phosphates as Electrophiles in Iron-Catalyzed Cross-Couplings
  作者：Thomas M. Gøgsig、Anders T. Lindhardt、Troels Skrydstrup

  DOI：10.1021/ol901975u

  日期：2009.11.5

  Employment of heteroaromatic tosylates and phosphates as suitable electrophiles in iron-catalyzed cross-coupling reactions with alkyl Grignard reagents is reported. These reactions are performed at low temperature allowing good functional group tolerance and full conversion is achieved within minutes. In addition, an aryl-aryl cross-coupling utilizing a heteroaryl sulfamate electrophile is reported.
• Arbusow; Soroastrowa, Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1958, p. 1331,1337; engl. Ausg. S. 1284, 1289
  作者：Arbusow、Soroastrowa

  DOI：——

  日期：——