methyl 4-(4-tert-butoxycarbonyl-3-methyl-phenyl)-2-(3,5-dichlorophenyl)-2-(trifluoromethyl)-3H-thiophene-5-carboxylate

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: methyl 4-(4-tert-butoxycarbonyl-3-methyl-phenyl)-2-(3,5-dichlorophenyl)-2-(trifluoromethyl)-3H-thiophene-5-carboxylate
• 英文别名: methyl 2-(3,5-dichlorophenyl)-4-[3-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]-2-(trifluoromethyl)-3H-thiophene-5-carboxylate
• 化学式: C₂₅H₂₃Cl₂F₃O₄S
• 分子量: 547.4
• InChiKey: MZPIBOIIVBWTQL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.5
• 重原子数：
  35
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  77.9
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  ethyl 3-(4-tert-butoxycarbonyl-3-methylphenyl)-5-(3,5-dichlorophenyl)-3-hydroxy-5-(trifluoromethyl)tetrahydrothiophene-2-carboxylate 、 氯化亚砜 、 盐酸 、 methyl 4-(4-tert-butoxycarbonyl-3-methyl-phenyl)-2-(3,5-dichlorophenyl)-2-(trifluoromethyl)-3H-thiophene-5-carboxylate 在 乙酸乙酯 、 Sodium sulfate-III 、 cyclohexane, ethyl acetate 作用下， 以 吡啶 、 水 为溶剂， 反应 4.0h， 生成 ethyl 4-(4-tert-butoxycarbonyl-3-methylphenyl)-2-(3.5-dichlorophenyl)-2-(trifluoromethyl)-3H-thiophene-5-carboxylate
  参考文献：
  名称：

  DIHYDROTHIOPHENE DERIVATIVES AS INSECTICIDAL COMPOUNDS

  摘要：

  本发明提供了式（I）的化合物，其中Q是Q1或Q2，P是P0，杂环基或杂环基上取代1至5个Z；Y1、Y2、Y3和Y4分别独立地是C-H、C-R5或氮；G1是氧或硫；R1是氢、C1-C8烷基、C1-C8烷氧基、C1-C8烷基羰基或C1-C8烷氧羰基；X4是C1-C8卤代烷基；R4是芳基或芳基上取代1至5个R9，或杂芳基或杂芳基上取代1至5个R9；n为0、1或2；以及Z、R2、R5和R9如权利要求所定义。本发明还提供了一种控制昆虫、螨、线虫或软体动物的方法，包括向害虫、害虫的地点或易受害虫攻击的植物施用式（I）的杀虫、杀螨、杀线虫或杀软体动物有效量的化合物。

  公开号：

  US20150272120A1

文献信息

• [EN] DIHYDROTHIOPHENE DERIVATIVES AS INSECTICIDAL COMPOUNDS<br/>[FR] DÉRIVÉS DE DIHYDROTHIOPHÈNE UTILISÉS COMME COMPOSÉS INSECTICIDES
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2014072480A1

  公开（公告）日：2014-05-15

  The present invention provides compounds of formula (I) wherein Q is Q1 or Q2 P is P0, heterocyclyl or heterocyclyl substituted by one to five Z; Y1, Y2, Y3 and Y4 are independently of each other C-H, C-R5, or nitrogen; G1 is oxygen or sulfur; R1 is hydrogen, C1-C8alkyl, C1-C8alkoxy-, C1-C8alkylcarbonyl-, or C1-C8alkoxycarbonyl-; X4 is C1-C8haloalkyl; R4 is aryl or aryl substituted by one to five R9, or heteroaryl or heteroaryl substituted by one to five R9; n is 0, 1 or 2; and Z, R2, R5 and R9 are as defined in the claims. The invention also provides methods of controlling insects, acarines, nematodes or molluscs comprising applying to a pest, to a locus of a pest, or to a plant susceptible to attack by a pest an insecticidally, acaricidally, nematicidally or molluscicidally effective amount of a compound of formula (I).

  本发明提供了式（I）的化合物，其中Q是Q1或Q2，P是P0，杂环烷基或被1至5个Z取代的杂环烷基；Y1、Y2、Y3和Y4彼此独立地是C-H、C-R5或氮；G1是氧或硫；R1是氢、C1-C8烷基、C1-C8烷氧基、C1-C8烷基羰基或C1-C8烷氧羰基；X4是C1-C8卤代烷基；R4是芳基或被1至5个R9取代的芳基，或者是杂芳基或被1至5个R9取代的杂芳基；n为0、1或2；Z、R2、R5和R9的定义如权利要求中所述。该发明还提供了一种控制昆虫、螨虫、线虫或软体动物的方法，包括向害虫、害虫的生境或易受害虫侵袭的植物施加式（I）化合物的杀虫、杀螨、杀线虫或杀软体动物的有效量。
• DIHYDROTHIOPHENE DERIVATIVES AS INSECTICIDAL COMPOUNDS
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：US20150272120A1

  公开（公告）日：2015-10-01

  The present invention provides compounds of formula (I) wherein Q is Q1 or Q2 P is P0, heterocyclyl or heterocyclyl substituted by one to five Z; Y 1 , Y 2 , Y 3 and Y 4 are independently of each other C—H, C—R 5 , or nitrogen; G 1 is oxygen or sulfur; R 1 is hydrogen, C 1 -C 8 alkyl, C 1 -C 8 alkoxy-, C 1 -C 8 alkylcarbonyl-, or C 1 -C 8 alkoxycarbonyl-; X 4 is C 1 -C 8 haloalkyl; R 4 is aryl or aryl substituted by one to five R 9 , or heteroaryl or heteroaryl substituted by one to five R 9 ; n is 0, 1 or 2; and Z, R 2 , R 5 and R 9 are as defined in the claims. The invention also provides methods of controlling insects, acarines, nematodes or molluscs comprising applying to a pest, to a locus of a pest, or to a plant susceptible to attack by a pest an insecticidally, acaricidally, nematicidally or molluscicidally effective amount of a compound of formula (I).

  本发明提供了式（I）的化合物，其中Q是Q1或Q2，P是P0，杂环基或杂环基上取代1至5个Z；Y1、Y2、Y3和Y4分别独立地是C-H、C-R5或氮；G1是氧或硫；R1是氢、C1-C8烷基、C1-C8烷氧基、C1-C8烷基羰基或C1-C8烷氧羰基；X4是C1-C8卤代烷基；R4是芳基或芳基上取代1至5个R9，或杂芳基或杂芳基上取代1至5个R9；n为0、1或2；以及Z、R2、R5和R9如权利要求所定义。本发明还提供了一种控制昆虫、螨、线虫或软体动物的方法，包括向害虫、害虫的地点或易受害虫攻击的植物施用式（I）的杀虫、杀螨、杀线虫或杀软体动物有效量的化合物。