1-methylethyl 5-amino-2-chloro-4-fluorobenzoate | 86819-51-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-methylethyl 5-amino-2-chloro-4-fluorobenzoate
• 英文别名: 4-chloro-2-fluoro-5-isopropoxycarbonylaniline；isopropyl 2-chloro-4-fluoro-5-aminobenzoate；isopropyl 5-amino-2-chloro-4-fluorobenzoate；Propan-2-yl 5-amino-2-chloro-4-fluorobenzoate
• CAS: 86819-51-4
• 化学式: C₁₀H₁₁ClFNO₂
• 分子量: 231.654
• InChiKey: MBDKOICXUFICGP-UHFFFAOYSA-N

物化性质

• 沸点：
  323.1±37.0 °C(Predicted)
• 密度：
  1.293±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  52.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-methylethyl 5-amino-2-chloro-4-fluorobenzoate 生成 1-methylethyl 2-chloro-4-fluoro-5-isothiocyanato-benzoate
  参考文献：
  名称：

  摘要：

  DOI：

文献信息

• Thiocarboxylate ester compounds compositions containing the same
  申请人：Uniroyal Chemical Company, Inc.

  公开号：US05268389A1

  公开（公告）日：1993-12-07

  A method of inhibiting the growth or replication of viruses of the HIV group is disclosed. Also disclosed are compounds useful in the method and pharmaceutical formulations incorporating such compounds. The method involves the use of compounds having the general formula: ##STR1## wherein the substituent groups are as defined in the specification.

  本发明揭示了一种抑制HIV病毒群的生长或复制的方法。还揭示了在该方法中有用的化合物以及含有这些化合物的药物配方。该方法涉及使用具有以下一般结构的化合物：##STR1##其中取代基如规范中定义。
• Heterocyclic compound and a herbicidal composition containing said
  申请人：Nippon Kayaku Kabushiki Kaisha

  公开号：US04531964A1

  公开（公告）日：1985-07-30

  A compound of the formula: ##STR1## wherein R.sub.4 is lower alkyl, X is oxygen or sulfur, and n is integer of 3 or 4; R.sub.1 is hydrogen or halogen; R.sub.2 is halogen; R.sub.3 is hydrogen or C.sub.1 -C.sub.8 -alkyl which may have lower alkoxy; a herbicidal composition containing said compound as an effective component; a method for killing weeds using said compound; and processes for the production of said compound, are disclosed hereinafter.

  该化合物的化学式为: ##STR1## 其中R.sub.4为较低的烷基，X为氧或硫，n为3或4的整数；R.sub.1为氢或卤素；R.sub.2为卤素；R.sub.3为氢或C.sub.1 -C.sub.8 -烷基，可能含有较低的烷氧基；本文披露了一种含有该化合物作为有效成分的除草剂组合物；一种利用该化合物杀死杂草的方法；以及生产该化合物的工艺过程。
• 1H[1,2,4]-Triazolo[1,2-a]pyridazine-1,3-diones useful as herbicides
  申请人：Nippon Kayaku Kabushiki Kaisha

  公开号：US04561880A1

  公开（公告）日：1985-12-31

  A compound of the formula: ##STR1## wherein Z is ##STR2## wherein R.sub.4 is lower alkyl, X and Y are oxygen or sulfur and n is an integer of 3 to 6, R.sub.1 is hydrogen or halogen, R.sub.2 is halogen and R.sub.3 is hydrogen or C.sub.1 -C.sub.8 -alkyl which may have lower alkoxy; a herbicidal composition containing said compound as an effective component; a method for killing weeds using said compound; and processes for the production of said compound, are disclosed hereinafter.

  一种化合物的分子式为：##STR1## 其中Z为##STR2## 其中R.sub.4为较低的烷基，X和Y为氧或硫，n为3至6的整数，R.sub.1为氢或卤素，R.sub.2为卤素，R.sub.3为氢或C.sub.1 -C.sub.8 -烷基，可能带有较低的烷氧基；包含该化合物作为有效成分的除草剂组合物；使用该化合物杀灭杂草的方法；以及该化合物的生产方法，以下将披露。
• 2-Aryl-5-trifluoromethylpyridines
  申请人：——

  公开号：US20040043903A1

  公开（公告）日：2004-03-04

  The present invention relates to 2-aryl-5-trifluoromethylpyridines of the formula I 1 in which the variables m, R 1 , R 2 , R 3 , R 4 , R 5 , R 6 and X have the meanings given in claim 1, and their agriculturally tolerated salts. Moreover, the invention relates to the use of compounds I and their salts as herbicides and/or for the desiccation and/or defoliation of plants, to herbicidal compositions and compositions for the desiccation and/or defoliation of plants comprising the compounds I and/or their salts as active substances.

  本发明涉及具有以下通式I中给定的变量m、R1、R2、R3、R4、R5、R6和X含义的2-芳基-5-三氟甲基吡啶，以及它们在农业中可容忍的盐。此外，本发明涉及化合物I及其盐作为除草剂和/或用于植物干燥和/或落叶的用途，以及包含化合物I和/或其盐作为活性物质的除草剂组合物和用于植物干燥和/或落叶的组合物。
• A Facile Synthesis of Novel Herbicidal 1-Phenyl-piperazine-2,6-diones
  作者：B. Li、D. Xiang、C. Hsu、Z. Liu、C. Wu、H. Yang

  DOI：10.3390/10091119

  日期：——

  Novel 1-phenyl-piperazine-2,6-diones were prepared by a new facile synthetic routeusing methyl N-substituted iminomonoacetate as starting material. The structures of thesecompounds were established by 1H-NMR, 13C-NMR and GC/MS. 2-(4-Chloro-5-cyclo-pentyl-oxy-2-fluorophenyl)-tetrahydro-2H-pyrido-[1,2-a]-pyrazine-1,3-(4H,6H)-dione displayed thegreatest herbicidal activity.

  新型1-苯基-哌嗪-2,6-二酮通过一种新的简便合成路线，使用N-取代的甲基单乙酸亚胺作为起始材料制备而成。这些化合物的结构通过1H-NMR、13C-NMR和气相色谱/质谱（GC/MS）确立。2-(4-氯-5-环戊基-O-2-氟苯基)-四氢-2H-吡啶-[1,2-a]-吡唑-1,3-(4H,6H)-二酮表现出最强的除草活性。