7-chloro-5-methyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine | 866790-88-7

• 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: 7-chloro-5-methyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
• 英文别名: 5-methyl-6-(2,4,6-trifluorophenyl)-7-chloro-[1,2,4]triazolo[1,5-a]pyrimidine；7-Chloro-5-methyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
• CAS: 866790-88-7
• 化学式: C₁₂H₆ClF₃N₄
• 分子量: 298.655
• InChiKey: VFKUESIUNQCWFJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  20
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  43.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  7-chloro-5-methyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine 、 (R)-(-)-3-甲基-2-丁胺 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 14.0h， 生成 5-methyl-6-(2,4,6-trifluorophenyl)-7-[(R)-1,2-dimethylprop-1-ylamino]-[1,2,4]triazolo[1,5-a]pyrimidine
  参考文献：
  名称：

  [DE] 6-(2-FLUORPHENYL)-TRIAZOLOPYRIMIDINE, VERFAHREN ZU IHRER HERSTELLUNG UND IHRE VERWENDUNG ZUR BEKÄMPFUNG VON SCHADPILZEN SOWIE SIE ENTHALTENDE MITTEL
  [EN] 6-(2-FLUOROPHENYL)-TRIAZOLOPYRIMIDINES, METHOD FOR PRODUCING THEM, THEIR USE FOR CONTROLLING PARASITIC FUNGI AND AGENTS CONTAINING THE SAME
  [FR] 6-(2-FLUOROPHENYL)-TRIAZOLOPYRIMIDINES, PROCEDE DE PRODUCTION DESDITS COMPOSES, LEUR UTILISATION DANS LA LUTTE CONTRE DES CHAMPIGNONS PARASITES ET DES AGENTS CONTENANT LESDITS COMPOSES

  摘要：

  公开号：

  WO2005095404A3
• 作为产物：
  描述：

  5-methyl-6-(2,4,6-trifluorophenyl)-7-hydroxy-[1,2,4]triazolo[1,5-a]pyrimidine 在 三氯氧磷 作用下， 反应 8.0h， 生成 7-chloro-5-methyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
  参考文献：
  名称：

  [DE] 6-(2-FLUORPHENYL)-TRIAZOLOPYRIMIDINE, VERFAHREN ZU IHRER HERSTELLUNG UND IHRE VERWENDUNG ZUR BEKÄMPFUNG VON SCHADPILZEN SOWIE SIE ENTHALTENDE MITTEL
  [EN] 6-(2-FLUOROPHENYL)-TRIAZOLOPYRIMIDINES, METHOD FOR PRODUCING THEM, THEIR USE FOR CONTROLLING PARASITIC FUNGI AND AGENTS CONTAINING THE SAME
  [FR] 6-(2-FLUOROPHENYL)-TRIAZOLOPYRIMIDINES, PROCEDE DE PRODUCTION DESDITS COMPOSES, LEUR UTILISATION DANS LA LUTTE CONTRE DES CHAMPIGNONS PARASITES ET DES AGENTS CONTENANT LESDITS COMPOSES

  摘要：

  公开号：

  WO2005095404A3

文献信息

• 6-(2-Fluorophenyl)-Triazolopyrimidines, Method for Producing Them, Their use for Controlling Parasitic Fungi and Agents Containing the Same
  申请人：Blettner Carsten

  公开号：US20070208038A1

  公开（公告）日：2007-09-06

  6-(2-Fluorophenyl)-triazolopyrimidines of the formula I in which the substituents are as defined below: R 1 is C 4 -C 8 -alkyl, C 4 -C 8 -haloalkyl, substituted C 3 -C 8 -cycloalkyl, C 3 -C 8 -halocycloalkyl, C 5 -C 8 -alkenyl, C 2 -C 8 -haloalkenyl, C 3 -C 6 -cycloalkenyl, C 3 -C 6 -halocycloalkenyl, C 2 -C 8 -alkynyl, C 2 -C 8 -haloalkynyl or phenyl, naphthyl, or a five- or six-membered saturated, partially unsaturated or aromatic heterocycle which contains one to four heteroatoms from the group consisting of O, N and S, R 2 is hydrogen, C 1 -C 3 -alkyl or one of the groups mentioned under R 1 , R 1 and R 2 together with the nitrogen atom to which they are attached may also form a five- or six-membered heterocyclyl or heteroaryl which is attached via N and contain one to three further heteroatoms from the group consisting of O, N and S as ring member, except for piperidin-1-yl optionally substituted by methyl groups; R 1 and/or R 2 may be substituted according to the description; L 1 is chlorine or fluorine; L 2 is hydrogen, is, if L 1 is fluorine, also fluorine; X is alkyl; processes for preparing these compounds, compositions comprising them and their use for controlling phytopathogenic harmful fungi.
• [DE] 6-(2-FLUORPHENYL)-TRIAZOLOPYRIMIDINE, VERFAHREN ZU IHRER HERSTELLUNG UND IHRE VERWENDUNG ZUR BEKÄMPFUNG VON SCHADPILZEN SOWIE SIE ENTHALTENDE MITTEL<br/>[EN] 6-(2-FLUOROPHENYL)-TRIAZOLOPYRIMIDINES, METHOD FOR PRODUCING THEM, THEIR USE FOR CONTROLLING PARASITIC FUNGI AND AGENTS CONTAINING THE SAME<br/>[FR] 6-(2-FLUOROPHENYL)-TRIAZOLOPYRIMIDINES, PROCEDE DE PRODUCTION DESDITS COMPOSES, LEUR UTILISATION DANS LA LUTTE CONTRE DES CHAMPIGNONS PARASITES ET DES AGENTS CONTENANT LESDITS COMPOSES
  申请人：BASF AG

  公开号：WO2005095404A3

  公开（公告）日：2006-04-06