Hydrochloric Acid → Hydrochloric Acid

HRID 181936

Reaction equation

HRID 181936 reaction equation
[CH:30]([OH:31])([CH3:32])[CH3:33].[Cl:2][c:3]1[n:4][cH:5][n:6][c:7]2[cH:8][c:9]([N+:13](=[O:14])[O-:15])[cH:10][cH:11][c:12]12.[ClH:1].[F:16][c:17]1[c:18]([NH2:19])[cH:20][c:21]([O:25][C:26](=[O:27])[O:28][CH3:29])[c:22]([CH3:24])[cH:23]1>>[ClH:2].[c:3]1([NH:19][c:18]2[c:17]([F:16])[cH:23][c:22]([CH3:24])[c:21]([O:25][C:26](=[O:27])[O:28][CH3:29])[cH:20]2)[n:4][cH:5][n:6][c:7]2[cH:8][c:9]([N+:13](=[O:14])[O-:15])[cH:10][cH:11][c:12]12

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 3776IsopropanolHCID 8306804-Chloro-7-nitroquinazolineHCID 226250465-Amino-4-fluoro-2-methylphenyl Methoxyformate

Product 2

HCID 313Hydrochloric AcidHCID 22625048[4-Fluoro-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl carbonate

Sources & evidence

ORD record
ord-bedc9d55356d44bfaf53d3307c0e9eac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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