N-[[4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-[2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl]-1-naphthalenyl]carbonyl]glycine | 943846-97-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: N-[[4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-[2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl]-1-naphthalenyl]carbonyl]glycine
• 英文别名: N-[[4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-1-naphthalenyl]carbonyl]glycine；2-[[4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]naphthalene-1-carbonyl]amino]acetic acid
• CAS: 943846-97-7
• 化学式: C₂₃H₁₅Cl₂F₃N₂O₄
• 分子量: 511.284
• InChiKey: IZVQMPQVMFRSGT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  34
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  88
• 氢给体数：
  2
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  N-[[4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-[2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl]-1-naphthalenyl]carbonyl]glycine 在 PS(polymer supported)-carbodiimide 作用下， 以 二氯甲烷 为溶剂， 以81%的产率得到2-[4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-1-naphthalenyl]-5(4H)-oxazolone
  参考文献：
  名称：

  WO2008/154528

  摘要：

  公开号：
• 作为产物：
  描述：

  3-(4-bromo-1-naphthalenyl)-5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)isoxazole 在 (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride 、 三乙胺 、 lithium hydroxide 作用下， 以 四氢呋喃 、 水 、 甲苯 为溶剂， 反应 1.0h， 生成 N-[[4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-[2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl]-1-naphthalenyl]carbonyl]glycine
  参考文献：
  名称：

  나프탈렌 이속사졸린 무척추 해충 방제제

  摘要：

  化学式1：[化学式1]（其中，R1是卤素，C1-C2卤基或C1-C2卤酰基；R2是H，卤素或氰基；R3是H，卤素或CF3；R4是H，C2-C7烷基羰基或C2-C7烷氧羰基；以及R5是羟基，C1-C6烷氧基，C1-C6烷基硫，C1-C6烷基磺基，C1-C6烷基磺酰基，C2-C7烷基氨基羰基，C3-C9二烷基氨基羰基，C2-C7卤基烷基氨基羰基和C3-C9卤二烷基氨基羰基中独立选择的一个取代基，它们各自被取代的是C1-C6烷基或C1-C6卤基烷基）的化合物被提供。此外，本发明涉及含有化学式1的化合物的组合物，以及包括将无脊椎动物或其环境与本发明化合物或组合物的生物学有效量接触的步骤的无脊椎动物防治方法。

  公开号：

  KR101597838B1

文献信息

• NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS
  申请人：Lahm George Philip

  公开号：US20100254959A1

  公开（公告）日：2010-10-07

  Disclosed are compounds of Formula 1, wherein R 1 is halogen, C 1 -C 2 haloalkyl or C 1 -C 2 haloalkoxy; R 2 is H, halogen or cyano; R 3 is H, halogen or CF 3 ; R 4 is H, C 2 -C 7 alkylcarbonyl or C 2 -C 7 alkoxycarbonyl; and R 5 is C 1 -C 6 alkyl or C 1 -C 6 haloalkyl, each substituted with one substituent independently selected from hydroxy, C 1 -C 6 alkoxy, C 1 -C 6 alkylthio, C 1 -C 6 alkylsulfinyl, C 1 -C 6 alkylsulfonyl, C 2 -C 7 alkylaminocarbonyl, C 3 -C 9 dialkylaminocarbonyl, C 2 -C 7 haloalkylaminocarbonyl and C 3 -C 9 halodialkylaminocarbonyl. Also disclosed are compositions containing the compounds of Formula 1 and methods for controlling an invertebrate pest comprising contacting the invertebrate pest or its environment with a biologically effective amount of a compound or a composition of the invention.

  本文披露了Formula 1的化合物，其中R1是卤素，C1-C2卤代烷基或C1-C2卤代氧烷基；R2是H、卤素或氰基；R3是H、卤素或三氟甲基；R4是H、C2-C7烷基羰基或C2-C7烷氧羰基；R5是C1-C6烷基或C1-C6卤代烷基，每个都被一个取自羟基、C1-C6烷氧基、C1-C6烷基硫醚、C1-C6烷基亚砜基、C1-C6烷基砜基、C2-C7烷基氨基羰基、C3-C9二烷基氨基羰基、C2-C7卤代烷基氨基羰基和C3-C9卤代二烷基氨基羰基的取代基独立取代。还披露了含有Formula 1化合物的组合物以及用于控制无脊椎动物害虫的方法，包括将无脊椎动物害虫或其环境与本发明的化合物或组合物的生物有效量接触。
• ISOXAZOLINE INSECTICIDES
  申请人：Lahm George Philip

  公开号：US20100179195A1

  公开（公告）日：2010-07-15

  Disclosed are compounds of Formula 1, including all geometric and stereoisomers, N-oxides, and salts thereof, wherein A is a 6-membered aromatic ring containing carbon atoms and 0-3 nitrogen atoms as ring members, said ring optionally substituted with 1-5 substituents independently selected from R 2 ; R 1 is C 1 -C 6 alkyl, C 2 -C 6 alkenyl, C 2 -C 6 alkynyl, C 3 -C 6 cycloalkyl, C 4 -C 7 alkylcycloalkyl or C 4 -C 7 cycloalkylalkyl, each optionally substituted with one or more substituents independently selected from R 21 ; R 21 is independently H, halogen, C 1 -C 6 alkyl, C 1 -C 6 alkoxy, C 1 -C 6 haloalkoxy, C 1 -C 6 alkylthio, C 1 -C 6 haloalkylthio, C 1 -C 6 alkylsulfinyl, C 1 -C 6 haloalkylsulfinyl, C 1 -C 6 alkylsulfonyl, C 1 -C 6 haloalkylsulfonyl, CN or NO 2 ; and Q is as defined in the disclosure. Also disclosed are compositions containing the compounds of Formula 1 and methods for controlling an invertebrate pest comprising contacting the invertebrate pest or its environment with a biologically effective amount of a compound or a composition of the invention.

  本发明公开了Formula 1化合物，包括其所有的构型和立体异构体、N-氧化物和盐，其中A是一个6元芳香环，包含碳原子和0-3个氮原子作为环成员，该环可选地被1-5个独立选择的R2取代基取代；R1是C1-C6烷基、C2-C6烯基、C2-C6炔基、C3-C6环烷基、C4-C7烷基环烷基或C4-C7环烷基烷基，每个基可选地被一个或多个独立选择的R21取代基取代；R21独立地是氢、卤素、C1-C6烷基、C1-C6烷氧基、C1-C6卤代烷氧基、C1-C6烷基硫醇、C1-C6卤代烷基硫醇、C1-C6烷基亚砜、C1-C6卤代烷基亚砜、C1-C6烷基磺酰基、C1-C6卤代烷基磺酰基、CN或NO2；Q如本公开所定义。本发明还公开了含有Formula 1化合物的组合物以及使用本发明的化合物或组合物的生物有效量接触无脊椎动物害虫或其环境以控制无脊椎动物害虫的方法。
• Naphthalene isoxazoline invertebrate pest control agents
  申请人：Lahm George Philip

  公开号：US08410153B2

  公开（公告）日：2013-04-02

  Disclosed are compounds of Formula 1, wherein R1 is halogen, C1-C2 haloalkyl or C1-C2 haloalkoxy; R2 is H, halogen or cyano; R3 is H, halogen or CF3; R4 is H, C2-C7 alkylcarbonyl or C2-C7 alkoxycarbonyl; and R5 is C1-C6 alkyl or C1-C6 haloalkyl, each substituted with one substituent independently selected from hydroxy, C1-C6 alkoxy, C1-C6 alkylthio, C1-C6 alkylsulfinyl, C1-C6 alkylsulfonyl, C2-C7 alkylaminocarbonyl, C3-C9 dialkylaminocarbonyl, C2-C7 haloalkylaminocarbonyl and C3-C9 halodialkylaminocarbonyl. Also disclosed are compositions containing the compounds of Formula 1 and methods for controlling an invertebrate pest comprising contacting the invertebrate pest or its environment with a biologically effective amount of a compound or a composition of the invention.

  本发明涉及一种式子为1的化合物，其中R1为卤素、C1-C2卤代烷基或C1-C2卤代氧烷基；R2为氢、卤素或氰基；R3为氢、卤素或CF3基；R4为氢、C2-C7烷基羰基或C2-C7烷氧基羰基；R5为C1-C6烷基或C1-C6卤代烷基，每个烷基都被一个独立选择的取代基取代，所述取代基从羟基、C1-C6烷氧基、C1-C6烷基硫基、C1-C6烷基亚砜基、C1-C6烷基磺酰基、C2-C7烷基氨基羰基、C3-C9双烷基氨基羰基、C2-C7卤代烷基氨基羰基和C3-C9卤代双烷基氨基羰基中独立选择。 本发明还涉及含有式1化合物的组合物以及用一定量的本发明中化合物或组合物接触无脊椎动物害虫或它们的环境来控制无脊椎动物害虫的方法。
• Naphthalene Isoxazoline Invertebrate Pest Control Agents
  申请人：E. I. Du Pont de Nemours and Company

  公开号：US20130217736A1

  公开（公告）日：2013-08-22

  Disclosed are compounds of Formula 1, wherein R 1 is halogen, C 1 -C 2 haloalkyl or C 1 -C 2 haloalkoxy; R 2 is H, halogen or cyano; R 3 is H, halogen or CF 3 ; R 4 is H, C 2 -C 7 alkylcarbonyl or C 2 -C 7 alkoxycarbonyl; and R 5 is C 1 -C 6 alkyl or C 1 -C 6 haloalkyl, each substituted with one substituent independently selected from hydroxy, C 1 -C 6 alkoxy, C 1 -C 6 alkylthio, C 1 -C 6 alkylsulfinyl, C 1 -C 6 alkylsulfonyl, C 2 -C 7 alkylaminocarbonyl, C 3 -C 9 dialkylaminocarbonyl, C 2 -C 7 haloalkylaminocarbonyl and C 3 -C 9 halodialkylaminocarbonyl. Also disclosed are compositions containing the compounds of Formula 1 and methods for controlling an invertebrate pest comprising contacting the invertebrate pest or its environment with a biologically effective amount of a compound or a composition of the invention.

  本发明涉及一种化合物，其化学式为1，其中R1为卤素，C1-C2卤代烷基或C1-C2卤代氧烷基；R2为H，卤素或氰基；R3为H，卤素或CF3；R4为H，C2-C7烷基羰基或C2-C7烷氧羰基；R5为C1-C6烷基或C1-C6卤代烷基，每个烷基上都独立地取代一个取代基，所述取代基选择自羟基、C1-C6烷氧基、C1-C6烷基硫醚基、C1-C6烷基亚砜基、C1-C6烷基磺酰基、C2-C7烷基氨基羰基、C3-C9二烷基氨基羰基、C2-C7卤代烷基氨基羰基和C3-C9卤代二烷基氨基羰基。本发明还涉及含有化合物1的组合物以及用化合物或本发明的组合物的生物有效量与无脊椎动物害虫或其环境接触以控制无脊椎动物害虫的方法。
• Isoxazoline insecticides
  申请人：Lahm George Philip

  公开号：US08623875B2

  公开（公告）日：2014-01-07

  Disclosed are compounds of Formula 1, including all geometric and stereoisomers, N-oxides, and salts thereof, wherein A is a 6-membered aromatic ring containing carbon atoms and 0-3 nitrogen atoms as ring members, said ring optionally substituted with 1-5 substituents independently selected from R2; R1 is C1-C6 alkyl, C2-C6 alkenyl, C2-C6 alkynyl, C3-C6 cycloalkyl, C4-C7 alkylcycloalkyl or C4-C7 cycloalkylalkyl, each optionally substituted with one or more substituents independently selected from R21; R21 is independently H, halogen, C1-C6 alkyl, C1-C6 alkoxy, C1-C6 haloalkoxy, C1-C6 alkylthio, C1-C6 haloalkylthio, C1-C6 alkylsulfinyl, C1-C6 haloalkylsulfinyl, C1-C6 alkylsulfonyl, C1-C6 haloalkylsulfonyl, CN or NO2; and Q is as defined in the disclosure. Also disclosed are compositions containing the compounds of Formula 1 and methods for controlling an invertebrate pest comprising contacting the invertebrate pest or its environment with a biologically effective amount of a compound or a composition of the invention.

  本发明涉及公式1的化合物，包括其所有的几何和立体异构体、N-氧化物和盐，其中A为6元芳香环，包含碳原子和0-3个氮原子作为环成员，该环可选择地用1-5个独立选择的R2取代基取代；R1为C1-C6烷基、C2-C6烯基、C2-C6炔基、C3-C6环烷基、C4-C7烷基环烷基或C4-C7环烷基烷基，每个基可选择地用一个或多个独立选择的R21取代基取代；R21独立地为H、卤素、C1-C6烷基、C1-C6烷氧基、C1-C6卤代烷氧基、C1-C6烷硫基、C1-C6卤代烷硫基、C1-C6烷基亚磺酰基、C1-C6卤代烷基亚磺酰基、C1-C6烷基磺酰基、C1-C6卤代烷基磺酰基、CN或NO2；Q如本文所述。本发明还涉及包含公式1化合物的组合物和用化合物或本发明组合物的生物学有效量与无脊椎动物害虫或其环境接触以控制无脊椎动物害虫的方法。