Acetone → 5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-(1,2,4-oxadiazol-3-yl)pyrazole

HRID 146080Notes

Reaction equation

HRID 146080 reaction equation
[CH3:32][C:33](=[O:34])[CH3:35].[Cl:1][c:2]1[c:3](-[n:13]2[n:14][c:15](-[c:22]3[n:23][o:24][cH:25][n:26]3)[cH:16][c:17]2[N:18]=[CH:19][O:20][CH3:21])[c:4]([Cl:12])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[OH2:36].[S:27](=[O:28])(=[O:29])([OH:30])[OH:31]>>[Cl:1][c:2]1[c:3](-[n:13]2[n:14][c:15](-[c:22]3[n:23][o:24][cH:25][n:26]3)[cH:16][c:17]2[NH2:18])[c:4]([Cl:12])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 962WaterHCID 1118Sulfuric AcidHCID 571359491-(2,6-Dichloro-4-trifluoromethylphenyl)-5-methoxymethylideneamino-3-(1,2,4-oxadiazol-3-yl)pyrazole

Product 1

HCID 155403535-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-(1,2,4-oxadiazol-3-yl)pyrazole

Sources & evidence

ORD record
ord-5954e5c4c84f437f862959665a0e344e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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