O,O-dimethyl 1-((4,6-dichloropyrimidin-2-yl)carbamyloxy)methylphosphonate | 1614827-32-5

• 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: O,O-dimethyl 1-((4,6-dichloropyrimidin-2-yl)carbamyloxy)methylphosphonate
• CAS: 1614827-32-5
• 化学式: C₈H₁₀Cl₂N₃O₅P
• 分子量: 330.064
• InChiKey: RULRQHCVPTWDPE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.78
• 重原子数：
  19.0
• 可旋转键数：
  5.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  99.64
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  羟甲基膦酸二甲酯 、 4,6-dichloro-2-pyrimidinyl isocyanate 以 1,2-二氯乙烷 为溶剂， 反应 0.25h， 以61%的产率得到O,O-dimethyl 1-((4,6-dichloropyrimidin-2-yl)carbamyloxy)methylphosphonate
  参考文献：
  名称：

  Synthesis and Biological Activities of O,O-Dialkyl 1-((4,6-Dichloropyrimidin-2-yl)Carbamyloxy) Alkylphosphonates

  摘要：

  A series of new 1-((4,6-dichloropyrimidin-2-yl)carbamyloxy) alkylphosphonates were designed and synthesized. The structures of all the title compounds were confirmed by IR, H-1-NMR, P-31-NMR and elemental analysis. The results of the bioassay showed that all of title compounds exhibited weak herbicidal activities against monocotyledons and dicotyledons; however, some of them showed potential plant growth regulatory activities.

  DOI：

  10.1080/10426507.2013.855774