Trifluoroacetic acid → 2-[2-chloro-4-fluoro-5-(3-difluoromethyl-4,5-dihydro-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)phenoxy]propionic acid

HRID 690121Notes

Reaction equation

HRID 690121 reaction equation
[Cl:1][c:2]1[c:3]([O:4][CH:5]([C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[CH3:13])[cH:14][c:15](-[n:19]2[n:20][c:21]([CH:26]([F:27])[F:28])[n:22]([CH3:25])[c:23]2=[O:24])[c:16]([F:18])[cH:17]1.[OH:29][C:30]([C:31]([F:32])([F:33])[F:34])=[O:35]>>[Cl:1][c:2]1[c:3]([O:4][CH:5]([C:6](=[O:7])[OH:8])[CH3:13])[cH:14][c:15](-[n:19]2[n:20][c:21]([CH:26]([F:27])[F:28])[n:22]([CH3:25])[c:23]2=[O:24])[c:16]([F:18])[cH:17]1

Participants

3

Reactant 2

HCID 6422Trifluoroacetic acidHCID 14853654HCID 14853654, compound

Product 1

HCID 148536552-[2-chloro-4-fluoro-5-(3-difluoromethyl-4,5-dihydro-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)phenoxy]propionic acid

Sources & evidence

ORD record
ord-4ce4e02135364a838e38c3bd868e91bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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