Hydrochloric Acid → Hydrochloric Acid

HRID 694165Notes

Reaction equation

HRID 694165 reaction equation
[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][c:10]1[cH:11][cH:12][c:13]2[c:14]([NH:20][c:21]3[c:22]([F:33])[cH:23][c:24]([CH3:32])[c:25]([O:27][C:28](=[O:29])[O:30][CH3:31])[cH:26]3)[n:15][cH:16][n:17][c:18]2[cH:19]1.[CH3:34][OH:35].[Cl:41][CH:42]([Cl:43])[Cl:44].[ClH:1].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40]>>[ClH:1].[OH:9][c:10]1[cH:11][cH:12][c:13]2[c:14]([NH:20][c:21]3[c:22]([F:33])[cH:23][c:24]([CH3:32])[c:25]([O:27][C:28](=[O:29])[O:30][CH3:31])[cH:26]3)[n:15][cH:16][n:17][c:18]2[cH:19]1

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 887MethanolHCID 6212ChloroformHCID 6228DimethylformamideHCID 22624961[4-Fluoro-2-methyl-5-[(7-phenylmethoxyquinazolin-4-yl)amino]phenyl] methyl carbonate

Product 2

HCID 313Hydrochloric AcidHCID 135671178[4-Fluoro-5-[(7-hydroxyquinazolin-4-yl)amino]-2-methylphenyl] methyl carbonate

Sources & evidence

ORD record
ord-8b6fe53f2af643c3877fe51bbaf87464
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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