1-methyl-6-trifluoromethyl-3-(4-chloro-2-fluoro-5-hydroxy-6-nitrophenyl)-2,4(1H,3H)-pyrimidinedione | 212755-08-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 1-methyl-6-trifluoromethyl-3-(4-chloro-2-fluoro-5-hydroxy-6-nitrophenyl)-2,4(1H,3H)-pyrimidinedione
• 英文别名: 3-(4-chloro-6-fluoro-3-hydroxy-2-nitrophenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
• CAS: 212755-08-3
• 化学式: C₁₂H₆ClF₄N₃O₅
• 分子量: 383.643
• InChiKey: NDDSFBUCSBTIAN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  25
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  107
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  1-methyl-6-trifluoromethyl-3-(4-chloro-2-fluoro-5-hydroxy-6-nitrophenyl)-2,4(1H,3H)-pyrimidinedione 生成 1-methyl-6-trifluoromethyl-3-(6-amino-4-chloro-2-fluoro-5-hydroxy-phenyl)-2,4(1H,3H)-pyrimidinedione
  参考文献：
  名称：

  Novel oxygen containing fused cyclic derivatives and herbicidal, desiccant and defoliate compositions containing them

  摘要：

  公式（I）的含氧融合环化合物或其盐，其制备方法以及它们作为除草剂、植物生长调节剂、脱水剂和落叶剂的用途。公式（I）中的变量在规范中定义。

  公开号：

  US20040157738A1
• 作为产物：
  描述：

  2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidine-1-yl]phenol 生成 1-methyl-6-trifluoromethyl-3-(4-chloro-2-fluoro-5-hydroxy-6-nitrophenyl)-2,4(1H,3H)-pyrimidinedione
  参考文献：
  名称：

  Novel oxygen containing fused cyclic derivatives and herbicidal, desiccant and defoliate compositions containing them

  摘要：

  公式（I）的含氧融合环化合物或其盐，其制备方法以及它们作为除草剂、植物生长调节剂、脱水剂和落叶剂的用途。公式（I）中的变量在规范中定义。

  公开号：

  US20040157738A1

文献信息

• Cycloimido-substituted benzofused heterocyclic herbicides
  申请人：FMC Corporation

  公开号：US06352958B1

  公开（公告）日：2002-03-05

  Novel herbicidal compounds, compositions containing them, and methods for their use in controlling weeds are disclosed. The novel herbicidal compounds are represented by formula I: where J is a 1-substituted-6-trifluoromethyl-2,4-pyrimidinedione-3-yl, a 1-substituted-6-trifluoromethyl-1,3,5-triazine-2,4-dion-1-yl, a 3,4,5,6-tetrahydrophthalimid-1-yl, a 4-difluoromethyl-4,5-dihydro-3-methyl-1,2,4-triazol-5(1H)-on-1-yl, a 5,6,7,8-tetrahydro-1H,3H-[1,3,4]thiadiazolo[3,5-a]pyridazineimin-1-yl, or a 1,6,8-triazabicyclo[4.3.0]-nonane-7,9-dion-8-yl ring attached at the 7 position of a benzofuran, benzoxazole, indole, 2,3-dihydrobenzimidazole or benzimidazole, and X is selected from hydrogen, halogen, cyano, nitro, and amino. Preferred R groups are optionally substituted alkyl groups.

  揭示了一种新型除草化合物、含有它们的组合物以及在控制杂草中使用它们的方法。这些新型除草化合物由式I表示：其中J是1-取代-6-三氟甲基-2,4-嘧啶二酮-3-基、1-取代-6-三氟甲基-1,3,5-三嗪-2,4-二酮-1-基、3,4,5,6-四氢邻苯二酰亚胺-1-基、4-二氟甲基-4,5-二氢-3-甲基-1,2,4-三唑-5(1H)-酮-1-基、5,6,7,8-四氢-1H,3H-[1,3,4]噻二唑并咪唑啉-1-基，或者1,6,8-三氮杂双环[4.3.0]-壬烷-7,9-二酮-8-基环连接在苯并呋喃、苯并噁唑、吲哚、2,3-二氢苯并咪唑或苯并咪唑的7位，X选自氢、卤素、氰基、硝基和氨基。首选的R基是可选择地取代的烷基基团。
• Substituted benzene compounds, process for their preparation, and herbicidal and defoliant compositions containing them
  申请人：ISK AMERICAS INCORPORATED

  公开号：US20020133007A1

  公开（公告）日：2002-09-19

  Novel herbicidal and defoliant substituted aniline derived compounds represented by general structure (I) 1 are described. W, X, Y, Z, and Q are as defined in the disclosure. Also described are the processes for the manufacture of these compounds and agriculturally suitable compositions containing these as active ingredients which are useful as herbicides for general or selective pre-emergent or post-emergent control of undesired plant species and defoliants at very low concentrations of these biologically active compounds

  本发明涉及一种新型的除草和落叶取代苯胺衍生物化合物，其一般结构式为（I）1。其中，W、X、Y、Z和Q的定义如所述。本发明还描述了制造这些化合物的过程以及含有这些化合物作为活性成分的农业适用组合物，这些组合物在非常低的浓度下对非期望的植物物种具有除草和落叶作用，可以用作除草剂和落叶剂的普通或选择性前期或后期控制。
• USRE039590E1
  申请人：——

  公开号：——

  公开（公告）日：——
• CYCLOIMIDO-SUBSTITUTED BENZOFUSED HETEROCYCLIC HERBICIDES
  申请人：FMC CORPORATION

  公开号：EP0968207A1

  公开（公告）日：2000-01-05
• US6077812A
  申请人：——

  公开号：US6077812A

  公开（公告）日：2000-06-20