Dimethylformamide → 4-(5-(3,5-Dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-2-methylbenzoic acid

HRID 680605Notes

Reaction equation

HRID 680605 reaction equation
[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[Cl:15][c:16]1[c:17]([F:29])[c:18]([Cl:28])[cH:19][c:20]([C:22](=[CH2:23])[C:24]([F:25])([F:26])[F:27])[cH:21]1.[Cl:1][C:2]([c:3]1[cH:4][c:5]([CH3:12])[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11]1)=[N:13][OH:14].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41]>>[C:2]1([c:3]2[cH:4][c:5]([CH3:12])[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11]2)=[N:13][O:14][C:22]([c:20]2[cH:19][c:18]([Cl:28])[c:17]([F:29])[c:16]([Cl:15])[cH:21]2)([C:24]([F:25])([F:26])[F:27])[CH2:23]1

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 584682331,3-Dichloro-2-fluoro-5-(3,3,3-trifluoroprop-1-en-2-yl)benzeneHCID 86685466HCID 86685466, compound

Product 1

HCID 866854534-(5-(3,5-Dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-2-methylbenzoic acid

Sources & evidence

ORD record
ord-e61727be7ec546fca74ab6f853bc8264
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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