Potassium Cation → 3-(4-(Difluoromethoxy)-2-methylphenyl)-7-(3,5-dimethyl-1H-1,2,4-triazol-1-yl)-2,6-dimethylpyrazolo[5,1-b]oxazole

HRID 676436Notes

Reaction equation

HRID 676436 reaction equation
[C:26](=[O:27])([O-:28])[O-:29].[CH3:1][c:2]1[n:3][n:4](-[c:8]2[c:9]([CH3:25])[n:10][n:11]3[c:12]2[o:13][c:14]([CH3:24])[c:15]3-[c:16]2[c:17]([CH3:23])[cH:18][c:19]([OH:22])[cH:20][cH:21]2)[c:5]([CH3:7])[n:6]1.[Cl:32][C:33]([C:34]([O:35][CH3:36])=[O:37])([F:38])[F:39].[K+:30].[K+:31].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[CH3:1][c:2]1[n:3][n:4](-[c:8]2[c:9]([CH3:25])[n:10][n:11]3[c:12]2[o:13][c:14]([CH3:24])[c:15]3-[c:16]2[c:17]([CH3:23])[cH:18][c:19]([O:22][CH:33]([F:38])[F:39])[cH:20][cH:21]2)[c:5]([CH3:7])[n:6]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 73935Methyl chlorodifluoroacetateHCID 672125924-(7-(3,5-dimethyl-1H-1,2,4-triazol-1-yl)-2,6-dimethylpyrazolo[5,1-b]oxazol-3-yl)-3-methylphenol

Product 1

HCID 533087423-(4-(Difluoromethoxy)-2-methylphenyl)-7-(3,5-dimethyl-1H-1,2,4-triazol-1-yl)-2,6-dimethylpyrazolo[5,1-b]oxazole

Sources & evidence

ORD record
ord-3ad6f6911ad74e9388e6b5109707040c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…