Acetone → 5-(p-Aminophenyl)-1-(p-fluorophenyl)-1H-1,2,4-triazole

HRID 685624Notes

Reaction equation

HRID 685624 reaction equation
[CH3:23][C:24](=[O:25])[CH3:26].[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][n:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]([N+:19]([O-:20])=[O:21])[cH:17][cH:18]2)[cH:6][cH:7]1.[OH2:22]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][n:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)[cH:6][cH:7]1

Participants

4

Reactant 3

HCID 180AcetoneHCID 962WaterHCID 40619641-(p-Fluorophenyl)-5-(p-nitrophenyl)-1H-1,2,4-triazole

Product 1

HCID 126766705-(p-Aminophenyl)-1-(p-fluorophenyl)-1H-1,2,4-triazole

Sources & evidence

ORD record
ord-093f3ed65955486790b28e115de9992b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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