2,4-dichloro-6-[1,3]dioxolan-2-ylmethyl-[1,3,5]triazine | 1237503-69-3

• 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: 2,4-dichloro-6-[1,3]dioxolan-2-ylmethyl-[1,3,5]triazine
• 英文别名: 2,4-Dichloro-6-(1,3-dioxolan-2-ylmethyl)-1,3,5-triazine
• CAS: 1237503-69-3
• 化学式: C₇H₇Cl₂N₃O₂
• 分子量: 236.057
• InChiKey: STIHAYVKUPSDNY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  57.1
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  、 2,4-dichloro-6-[1,3]dioxolan-2-ylmethyl-[1,3,5]triazine 在 N,N-二异丙基乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 3.0h， 生成
  参考文献：
  名称：

  Combinatorial Solid-Phase Synthesis of 4,6-Diaryl and 4-Aryl, 6-Alkyl-1,3,5-triazines and Their Application to Efficient Biofuel Production

  摘要：

  Herein we report the solid-phase synthesis of a combinatorial aryl, alkyl-triazine library and its application to biofuel production. The combination of Grignard reactions and solid supported Suzuki coupling reactions afforded unique 120 triazine compounds with high purities and minimum purification steps. Through an unbiased phenotypic screening for improved biofuel generation in oleaginous yeast, we found one diaryl triazine derivative (E4) which increased the biolipid production up to 86%.

  DOI：

  10.1021/co300007a
• 作为产物：
  描述：

  三聚氯氰 、 以 四氢呋喃 为溶剂， 反应 8.0h， 生成 2,4-dichloro-6-[1,3]dioxolan-2-ylmethyl-[1,3,5]triazine
  参考文献：
  名称：

  Combinatorial Solid-Phase Synthesis of 4,6-Diaryl and 4-Aryl, 6-Alkyl-1,3,5-triazines and Their Application to Efficient Biofuel Production

  摘要：

  Herein we report the solid-phase synthesis of a combinatorial aryl, alkyl-triazine library and its application to biofuel production. The combination of Grignard reactions and solid supported Suzuki coupling reactions afforded unique 120 triazine compounds with high purities and minimum purification steps. Through an unbiased phenotypic screening for improved biofuel generation in oleaginous yeast, we found one diaryl triazine derivative (E4) which increased the biolipid production up to 86%.

  DOI：

  10.1021/co300007a