1-{4-[5-(3,5-dichloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-3-yl]-2-methyl-phenyl}-ethanone | 1233037-18-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-{4-[5-(3,5-dichloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-3-yl]-2-methyl-phenyl}-ethanone
• 英文别名: 1-[4-[5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]-2-methylphenyl]ethanone
• CAS: 1233037-18-7
• 化学式: C₁₉H₁₄Cl₂F₃NO₂
• 分子量: 416.227
• InChiKey: GKKUNTKCQHHDNQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  27
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  38.7
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  1-{4-[5-(3,5-dichloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-3-yl]-2-methyl-phenyl}-ethanone 在 盐酸羟胺 、 溶剂黄146 作用下， 以 甲醇 为溶剂， 以14%的产率得到1-{4-[5-(3,5-dichloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-3-yl]-2-methyl-phenyl}-ethanone oxime
  参考文献：
  名称：

  [EN] IMINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS
  [FR] COMPOSÉS IMINES POUR LUTTER CONTRE DES ANIMAUX NUISIBLES INVERTÉBRÉS

  摘要：

  公开号：

  WO2010072781A3
• 作为产物：
  描述：

  3-(4-bromo-3-methylphenyl)-5-(3,5-dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazole 在 di-(1-adamantyl)-n-butylphosphine 、 palladium diacetate 四甲基乙二胺 、 氢气 、 戴斯-马丁氧化剂 、 lithium chloride 作用下， 以 四氢呋喃 、 二氯甲烷 、 甲苯 为溶剂， -70.0~120.0 ℃ 、1.0 MPa 条件下， 反应 20.0h， 生成 1-{4-[5-(3,5-dichloro-phenyl)-5-trifluoromethyl-4,5-dihydro-isoxazol-3-yl]-2-methyl-phenyl}-ethanone
  参考文献：
  名称：

  [EN] PROCESS FOR PRODUCING IMINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS
  [FR] PROCÉDÉ DE PRODUCTION DE COMPOSÉS IMINE DESTINÉ À LUTTER CONTRE LES RAVAGEURS INVERTÉBRÉS

  摘要：

  本发明涉及一种制备式(I)芳香族羰基化合物和式(III)芳香族亚胺化合物的过程，包括在过渡金属配合物催化剂存在下，将(hetero)芳香族卤代或磺酸酯化合物(II)与一种一氧化碳和氢气的混合物反应的步骤。本发明还涉及特定的化合物III、包含它们的组合物以及它们用于对抗无脊椎动物害虫的用途。

  公开号：

  WO2011161130A1

文献信息

• METHOD FOR CATALYTIC ASYMMETRIC SYNTHESIS OF OPTICALLY ACTIVE ISOXAZOLINE COMPOUND, AND OPTICALLY ACTIVE ISOXAZOLINE COMPOUND
  申请人：NISSAN CHEMICAL INDUSTRIES, LTD.

  公开号：US20140350261A1

  公开（公告）日：2014-11-27

  There is provided a method for catalytic asymmetric synthesis of optically active isoxazoline compound and an optically active isoxazoline compound. A method for catalytic asymmetric synthesis of optically active isoxazoline compound of a formula (6) including reacting an α,β-unsaturated carbonyl compound of a formula (1) and a hydroxylamine in a solvent in the presence of a base by adding a chiral phase transfer catalyst. An optically active isoxazoline compound of a formula (13) that can be synthesized by the method.

  提供了一种催化不对称合成光学活性异噁唑啉化合物的方法和一种光学活性异噁唑啉化合物。一种催化不对称合成光学活性异噁唑啉化合物的方法，包括在溶剂中通过添加手性相转移催化剂，在碱的存在下反应式（1）的α，β-不饱和羰基化合物和羟肟，得到式（6）的光学活性异噁唑啉化合物。可以通过该方法合成式（13）的光学活性异噁唑啉化合物。
• [EN] SUBSTITUTED KETONIC ISOXAZOLINE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS<br/>[FR] COMPOSÉS D'ISOXAZOLINE CÉTONIQUES SUBSTITUÉS ET LEURS DÉRIVÉS POUR LUTTER CONTRE DES ANIMAUX NUISIBLES
  申请人：BASF SE

  公开号：WO2011092287A1

  公开（公告）日：2011-08-04

  The invention relates to substituted ketonic isoxazoline compounds of formula (I), to the enantiomers, diastereomers and salts thereof and to compositions comprising such compounds. The invention also relates to the use of the substituted ketonic isoxazoline compounds, of their salts or of compositions comprising them for combating animal pests. Furthermore the invention relates also to methods of applying such substituted ketonic isoxazoline compounds. The substituted ketonic isoxazoline compounds of the present invention are defined by the following formula (I) wherein A1 to A4, R1 to R3, (R4)p, (R5)q, X and (G)m are defined as in the description.

  本发明涉及一类公式(I)的取代酮异噁唑化合物，其对映异构体、顺反异构体和盐以及包含这些化合物的组合物。本发明还涉及使用所述取代酮异噁唑化合物、它们的盐或包含它们的组合物来对抗动物害虫。此外，本发明还涉及应用这些取代酮异噁唑化合物的方法。本发明的取代酮异噁唑化合物由以下公式(I)定义，其中A1至A4、R1至R3、(R4)p、(R5)q、X和(G)m在描述中定义。
• Imine Compounds for Combating Invertebrate Pests
  申请人：Koerber Karsten

  公开号：US20110263603A1

  公开（公告）日：2011-10-27

  The present invention relates to imine compounds which are useful for combating or controlling invertebrate pests, in particular arthropod pests and nematodes. The invention also relates to a method for controlling invertebrate pests by using these compounds and to plant propagation material and to an agricultural and a veterinary composition comprising said compounds.

  本发明涉及亚胺化合物，其对无脊椎动物害虫，特别是节肢动物害虫和线虫的控制和防治具有有用性。本发明还涉及使用这些化合物控制无脊椎动物害虫的方法，以及包括该化合物的植物繁殖材料和农业和兽医组合物。
• Substituted ketonic isoxazoline compounds and derivatives for combating animal pests
  申请人：Koerber Karsten

  公开号：US20120309620A1

  公开（公告）日：2012-12-06

  The invention relates to substituted ketonic isoxazoline compounds of formula (I), to the enantiomers, diastereomers and salts thereof and to compositions comprising such compounds. The invention also relates to the use of the substituted ketonic isoxazoline compounds, of their salts or of compositions comprising them for combating animal pests. Furthermore the invention relates also to methods of applying such substituted ketonic isoxazoline compounds. The substituted ketonic isoxazoline compounds of the present invention are defined by the following formula I: wherein A 1 to A 4 , R 1 to R 3 , (R 4 ) p , (R 5 ) q , X and (G) m are defined as in the description.

  本发明涉及式(I)的取代酮异噁唑化合物，其对映异构体、二对映异构体和盐，以及包含这些化合物的组合物。本发明还涉及使用所述取代酮异噁唑化合物、其盐或包含它们的组合物来对抗动物害虫。此外，本发明还涉及应用这些取代酮异噁唑化合物的方法。本发明的取代酮异噁唑化合物由以下式(I)定义：其中A1至A4、R1至R3、(R4)p、(R5)q、X和(G)m的定义如描述中所示。
• Process for Producing Imine Compounds for Combating Invertebrate Pests
  申请人：Koerber Karsten

  公开号：US20130102462A1

  公开（公告）日：2013-04-25

  The present invention relates to a process for producing aromatic carbonyl compounds of formula I and aromatic imine compounds of formula III comprising the step of reacting a (hetero)aromatic halogen or sulfonate compound II wherein the variables are as defined in the claims and description, with a mixture of carbon monoxide and hydrogen in the presence of a transition metal complex catalyst. The invention also relates to specific compounds III, to compositions comprising them and to their use for combating invertebrate pests.

  本发明涉及一种制备公式I的芳香族羰基化合物和公式III的芳香族亚胺化合物的方法，包括以下步骤：将（杂）芳香族卤代物或磺酸盐化合物II（其中变量如权利要求和说明中所定义）与一种过渡金属配合物催化剂在一氧化碳和氢的混合物存在下反应。本发明还涉及特定的化合物III，包括它们的组合物以及用于对抗无脊椎动物害虫的用途。