Acetone → Hydrochloric Acid

HRID 670189Notes

Reaction equation

HRID 670189 reaction equation
[CH3:26][CH:27]([OH:28])[CH3:29].[CH3:30][C:31](=[O:32])[CH3:33].[Cl:16][c:17]1[cH:18][c:19]([F:24])[c:20]([NH2:21])[cH:22][cH:23]1.[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([Cl:15])[c:9]([N+:12](=[O:13])[O-:14])[cH:10][c:11]12.[ClH:25]>>[ClH:1].[c:2]1([NH:21][c:20]2[c:19]([F:24])[cH:18][c:17]([Cl:16])[cH:23][cH:22]2)[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([Cl:15])[c:9]([N+:12](=[O:13])[O-:14])[cH:10][c:11]12

Participants

7

Reactant 5

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 3776IsopropanolHCID 938984-Chloro-2-fluoroanilineHCID 104904554,7-Dichloro-6-nitroquinazoline

Product 2

HCID 313Hydrochloric AcidHCID 224782517-chloro-N-(4-chloro-2-fluorophenyl)-6-nitroquinazolin-4-amine

Sources & evidence

ORD record
ord-5010a235e16b46589c54906a0b91f96d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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