Potassium Cation → 4-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-trifluoromethyl benzoic acid methyl ester

HRID 1135332Notes

Reaction equation

HRID 1135332 reaction equation
[CH3:1][O:2][C:3]([c:4]1[c:5]([I:27])[cH:6][c:7]([C:10]2=[N:11][O:12][C:13]([C:15]([F:16])([F:17])[F:18])([c:19]3[cH:20][c:21]([Cl:26])[cH:22][c:23]([Cl:25])[cH:24]3)[CH2:14]2)[cH:8][cH:9]1)=[O:28].[CH3:31][O:32][C:33]([C:34]([F:35])([F:36])[Cl:38])=[O:37].[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[Cu:45][I:46].[F-:29].[K+:30].[OH2:39]>>[CH3:1][O:2][C:3]([c:4]1[c:5]([C:34]([F:29])([F:35])[F:36])[cH:6][c:7]([C:10]2=[N:11][O:12][C:13]([C:15]([F:16])([F:17])[F:18])([c:19]3[cH:20][c:21]([Cl:26])[cH:22][c:23]([Cl:25])[cH:24]3)[CH2:14]2)[cH:8][cH:9]1)=[O:28]

Participants

8

Reactant 7

HCID 813Potassium CationHCID 962WaterHCID 6228DimethylformamideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 28179Fluoride IonHCID 73935Methyl chlorodifluoroacetateHCID 667844134-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-iodo benzoic acid methyl ester

Product 1

HCID 595634864-[5-(3,5-Dichlorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-trifluoromethyl benzoic acid methyl ester

Sources & evidence

ORD record
ord-47b847d9eca8476cb1f3de1cf879dff2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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