1-(4-chlorophenoxy)-(1-diazirin-1-yl)-3,3-dimethyl-butan-2-one | 183852-17-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1-(4-chlorophenoxy)-(1-diazirin-1-yl)-3,3-dimethyl-butan-2-one
• 英文别名: 1-(4-Chlorophenoxy)-1-(1H-diaziren-1-yl)-3,3-dimethylbutan-2-one；1-(4-chlorophenoxy)-1-(diazirin-1-yl)-3,3-dimethylbutan-2-one
• CAS: 183852-17-7
• 化学式: C₁₃H₁₅ClN₂O₂
• 分子量: 266.727
• InChiKey: WEMBBHCMNFNNNY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  41.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  三唑酮 以 丙酮 为溶剂， 反应 4.0h， 生成 1-[(4-氯苯氧基)甲基]-1,2,4-三唑 、 3,3-二甲基-1-(1H-1,2,4-三唑-1-基)丁-2-酮 、 1-(4-chlorophenoxy)-2,2-dimethyl-1-(1,2,4-triazol-1-yl)propane 、 1-(4-chlorophenoxy)-(1-diazirin-1-yl)-3,3-dimethyl-butan-2-one
  参考文献：
  名称：

  Phototransformation of Triadimefon on Glass and Soil Surfaces

  摘要：

  Photodegradation of triadimefon has been studied on glass and soil surfaces. A number of photoproducts have been isolated and characterised by NMR, IR and MS. Photolysis resulted in considerable amounts of 1-(4-chlorophenoxymethyl)-1,2,4-triazole, 1-(4-chlorophenoxy)-2,2-dimethyl- 1-(1,2,4-triazol-1-yl)propane, 1-(1,2,4-triazol-1-yl)-3,3-dimethylbutan-2-one and 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol. Rates of photodegradation on glass and soil surfaces under UV and sunlight followed first-order kinetics with a significant correlation coefficient. Photodegradation was greater on alluvial soil than on laterite soil.

  DOI：

  10.1002/(sici)1096-9063(199611)48:3<247::aid-ps465>3.0.co;2-x

文献信息

• Phototransformation of Triadimefon on Glass and Soil Surfaces
  作者：Subir K. Nag、Prem Dureja

  DOI：10.1002/(sici)1096-9063(199611)48:3<247::aid-ps465>3.0.co;2-x

  日期：1996.11

  Photodegradation of triadimefon has been studied on glass and soil surfaces. A number of photoproducts have been isolated and characterised by NMR, IR and MS. Photolysis resulted in considerable amounts of 1-(4-chlorophenoxymethyl)-1,2,4-triazole, 1-(4-chlorophenoxy)-2,2-dimethyl- 1-(1,2,4-triazol-1-yl)propane, 1-(1,2,4-triazol-1-yl)-3,3-dimethylbutan-2-one and 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol. Rates of photodegradation on glass and soil surfaces under UV and sunlight followed first-order kinetics with a significant correlation coefficient. Photodegradation was greater on alluvial soil than on laterite soil.