N-(2-chlorophenyl)-4,6-dimethoxy-1,3,5-triazine-2-amine | 27315-26-0

• 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: N-(2-chlorophenyl)-4,6-dimethoxy-1,3,5-triazine-2-amine
• 英文别名: 2.4-Dimethoxy-6-(o-chloranilino)-s-triazin；(2-chloro-phenyl)-(4,6-dimethoxy-[1,3,5]triazin-2-yl)-amine；N-(2-chlorophenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
• CAS: 27315-26-0
• 化学式: C₁₁H₁₁ClN₄O₂
• 分子量: 266.687
• InChiKey: STEKDOGPPVMSHK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  69.2
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N-(2-chlorophenyl)-4,6-dimethoxy-1,3,5-triazine-2-amine 、 sodium hydroxide 、 叔丁醇 、 水 生成 4,6-dimethoxy-2-phenylamino-sym-triazine
  参考文献：
  名称：

  BAKLANOV, M. V.;FROLOV, A. N., ZH. ORGAN. XIMII, 27,(1991) N, S. 638-649

  摘要：

  DOI：
• 作为产物：
  描述：

  敌菌灵 、 乙醛 在 sodium carbonate 作用下， 以 甲醇 为溶剂， 反应 0.5h， 以96.8%的产率得到N-(2-chlorophenyl)-4,6-dimethoxy-1,3,5-triazine-2-amine
  参考文献：
  名称：

  Interaction of aquatic substances with anilazine and its derivatives: The nature of the bound residues

  摘要：

  This study is focused on the binding behaviour of the triazine fungicide anilazine and its main metabolites such as dihydroxyanilazine in aquatic ecosystems. For this purpose anilazine and its derivatives were incubated with ultrafiltrated dissolved organic matter (DOM) and isolated fulvic and humic acids, respectively and the adsorption isotherms according to Freundlich were determined. More than 90% bound residues were formed and up to 60% of anilazine metabolites were released with a recently developed silylation method. The study of the reactivity of metabolites and model compounds as well as our NMR investigations showing ether bondings led to a suggested binding scheme of anilazine to humic substances. To have more realistic conditions the behaviour of anilazine and dihydroxyanilazine in aquatic model ecosystems with water and sediment from a river was also part of this study. Furthermore the release of active ingredients or derivatives from sediment by different extraction methods was examined. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0045-6535(98)00050-2

文献信息

• BAKLANOV, M. V.;FROLOV, A. N., ZH. ORGAN. XIMII, 27,(1991) N, S. 638-649
  作者：BAKLANOV, M. V.、FROLOV, A. N.

  DOI：——

  日期：——
• Interaction of aquatic substances with anilazine and its derivatives: The nature of the bound residues
  作者：U. Klaus、S. Mohamed、M. Volk、M. Spiteller

  DOI：10.1016/s0045-6535(98)00050-2

  日期：1998.7

  This study is focused on the binding behaviour of the triazine fungicide anilazine and its main metabolites such as dihydroxyanilazine in aquatic ecosystems. For this purpose anilazine and its derivatives were incubated with ultrafiltrated dissolved organic matter (DOM) and isolated fulvic and humic acids, respectively and the adsorption isotherms according to Freundlich were determined. More than 90% bound residues were formed and up to 60% of anilazine metabolites were released with a recently developed silylation method. The study of the reactivity of metabolites and model compounds as well as our NMR investigations showing ether bondings led to a suggested binding scheme of anilazine to humic substances. To have more realistic conditions the behaviour of anilazine and dihydroxyanilazine in aquatic model ecosystems with water and sediment from a river was also part of this study. Furthermore the release of active ingredients or derivatives from sediment by different extraction methods was examined. (C) 1998 Elsevier Science Ltd. All rights reserved.