2-[1-(ethoxyimino)butyl]-3-benzoyloxy-5-(4,5-dimethyl-2-thiazolyl)cyclohex-2-en-1-one

• 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: 2-[1-(ethoxyimino)butyl]-3-benzoyloxy-5-(4,5-dimethyl-2-thiazolyl)cyclohex-2-en-1-one
• 英文别名: [5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(E)-N-ethoxy-C-propylcarbonimidoyl]-3-oxocyclohexen-1-yl] benzoate
• 化学式: C₂₄H₂₈N₂O₄S
• 分子量: 440.563
• InChiKey: OGFFNJUQDCXVEI-LGUFXXKBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  31
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  106
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  2-[1-(ethoxyimino)butyl]-5-(4,5-dimethyl-2-thiazolyl)-3-hydroxycyclohex-2-en-1-one 、 苯甲酰氯 生成 2-[1-(ethoxyimino)butyl]-3-benzoyloxy-5-(4,5-dimethyl-2-thiazolyl)cyclohex-2-en-1-one
  参考文献：
  名称：

  CONWAY, RICHARD JOHN;FARQUHARSON, GRAEME JOHN;WATSON, KEITH GEOFFREY

  摘要：

  DOI：

文献信息

• Herbicidal 5-(hetero-substituted) cyclohexane-1,3-dione derivatives
  申请人：ICI Australia Limited

  公开号：US04604132A1

  公开（公告）日：1986-08-05

  The invention concerns novel compounds of the formula I ##STR1## wherein: A, B and D are selected from CH and N; E is selected from oxygen and sulfur; X are selected from halogen, nitro, cyano, alkyl, substituted alkyl, hydroxy, alkoxy, substituted alkoxy, alkenyl, alkenyloxy, alkynyl, alkynyloxy, acyloxy, alkoxycarbonyl, alkylthio, alkylsulfinyl, alkylsulfonyl, sulfamoyl, substituted sulfamoyl, alkanoyloxy, benzyloxy, substituted benzyloxy, phenyl, substituted phenyl, amino, substituted amino, and the groups formyl and alkanoyl and the oxime, imine and Schiff base derivatives thereof; R.sup.1 is selected from hydrogen, alkyl, alkenyl, alkynyl, substituted alkyl, alkylsulfonyl, arylsulfonyl, acyl and an inorganic or organic cation; R.sup.2 is selected from alkyl substituted alkyl, alkenyl, haloalkenyl, alkynyl and haloalkynyl; R.sup.3 is selected from alkyl, fluoroalkyl, alkenyl, alkynyl, and phenyl; R.sup.4 is selected from hydrogen, halogen, alkyl, cyano and alkoxycarbonyl; and n is 0 or an integer chosen from 1 and 2. The compounds of the invention show herbicidal properties and plant growth regulating properties and in further embodiments the invention provides processes for the preparation of compounds of formula I, intermediates useful in the preparation of the compounds of formula I, compositions containing as active ingredient a compound of formula I, and herbicidal and plant growth regulating processes utilizing compounds of formula I.

  本发明涉及式I的新化合物，其中：A、B和D从CH和N中选择；E从氧和硫中选择；X从卤素、硝基、氰基、烷基、取代烷基、羟基、烷氧基、取代烷氧基、烯基、烯氧基、炔基、炔氧基、酰氧基、烷氧羰基、烷基硫基、烷基亚磺酰基、烷基磺酰基、磺酰胺基、取代磺酰胺基、烷酰氧基、苄氧基、取代苄氧基、苯基、取代苯基、氨基、取代氨基以及酰甲基和烷酰基和它们的肟、亚胺和席夫碱衍生物中选择；R1从氢、烷基、烯基、炔基、取代烷基、烷基磺酰基、芳基磺酰基、酰基和无机或有机阳离子中选择；R2从烷基取代烷基、烯基、卤代烯基、炔基和卤代炔基中选择；R3从烷基、氟代烷基、烯基、炔基和苯基中选择；R4从氢、卤素、烷基、氰基和烷氧羰基中选择；n为0或选择自1和2的整数。本发明的化合物具有除草和植物生长调节性能，在进一步的实施方式中，本发明提供了制备式I化合物的过程，有用于制备式I化合物的中间体，包含式I化合物作为活性成分的组合物，以及利用式I化合物的除草和植物生长调节过程。
• Herbicidal cyclohexane-1,3-dione derivatives
  申请人：ICI AUSTRALIA LIMITED

  公开号：EP0125094A2

  公开（公告）日：1984-11-14

  The invention concerns novel compounds of the formula wherein: A, B and D are selected from CH and N; E is selected from oxygen and sulfur; X are selected from halogen, nitro, cyano, alkyl, substituted alkyl, hydroxy, alkoxy, substituted alkoxy, alkenyl, alkenyloxy, alkynyl, alkynyloxy, acyloxy, alkoxycarbonyl, alkylthio, alkylsulfinyl, alkylsulfonyl, sulfamoyl, substituted sulfamoyl, alkanoyloxy, benzyloxy, substituted benzyloxy, phenyl, substituted phenyl, amino, substituted amino, and the groups formyl and alkanoyl and the oxime, imine and Schiff base derivatives thereof; R' is selected from hydrogen, alkyl, alkenyl, alkynyl, substituted alkyl, alkylsulfonyl, arylsulfonyl, acyl and an inorganic or organic cation; R2 is selected from alkyl substituted alkyl, alkenyl, haloalkenyl, alkynyl and haloalkynyl; R' is selected from alkyl, fluoroalkyl, alkenyl, alkynyl, and phenyl; R' is selected from hydrogen, halogen, alkyl, cyano and alkoxycarbonyl; and n is 0 or an integer chosen from 1 and 2. The compounds of the invention show herbicidal properties and plant growth regulating properties and in further embodiments the invnention provides processes for the preparation of compounds of formula I, intermediates useful in the preparation of the compounds of formula I, compositions containing as active ingredient a compound of formula I, and herbicidal and plant growth regulating processes utilizing compounds of formula I.

  本发明涉及式如下的新型化合物 其中 A、B 和 D 选自 CH 和 N； E选自氧和硫 X选自卤素、硝基、氰基、烷基、取代烷基、羟基、烷氧基、取代烷氧基、烯基、烯氧基、炔基、炔氧基、酰氧基、烷氧基羰基、烷硫基、烷基亚磺酰基、烷基磺酰基、氨基磺酰基、取代氨基磺酰基、烷酰氧基、苄氧基、取代苄氧基、烷酰氧基、苄氧基、取代的苄氧基、苯基、取代的苯基、氨基、取代的氨基、甲酰基和烷酰基及其肟、亚胺和希夫碱衍生物； R' 选自氢、烷基、烯基、炔基、取代烷基、烷基磺酰基、芳基磺酰基、酰基和无机或有机阳离子； R2 选自取代烷基、烯基、卤代烯基、炔基和卤代炔基； R' 选自烷基、氟烷基、烯基、炔基和苯基； R' 选自氢、卤素、烷基、氰基和烷氧羰基；以及 n 是 0 或选自 1 和 2 的整数。 本发明的化合物具有除草特性和植物生长调节特性，在进一步的实施方案中，本发明提供了制备式 I 化合物的工艺、用于制备式 I 化合物的中间体、含有式 I 化合物作为活性成分的组合物，以及利用式 I 化合物的除草和植物生长调节工艺。
• CONWAY, RICHARD JOHN;FARQUHARSON, GRAEME JOHN;WATSON, KEITH GEOFFREY
  作者：CONWAY, RICHARD JOHN、FARQUHARSON, GRAEME JOHN、WATSON, KEITH GEOFFREY

  DOI：——

  日期：——
• US4604132A
  申请人：——

  公开号：US4604132A

  公开（公告）日：1986-08-05
• US4715884A
  申请人：——

  公开号：US4715884A

  公开（公告）日：1987-12-29