Hydrochloric Acid → Hydrochloric Acid

HRID 175434Notes

Reaction equation

HRID 175434 reaction equation
[CH3:33][OH:34].[ClH:32].[F:3][c:4]1[c:5]([NH:6][c:7]2[n:8][cH:9][n:10][c:11]3[cH:12][c:13]([NH:17][CH2:18][CH2:19][O:20][CH3:21])[cH:14][cH:15][c:16]23)[cH:22][c:23]([O:27][C:28]([O:29][CH3:30])=[O:31])[c:24]([CH3:26])[cH:25]1.[Na+:2].[OH-:1].[OH2:35]>>[ClH:32].[F:3][c:4]1[c:5]([NH:6][c:7]2[n:8][cH:9][n:10][c:11]3[cH:12][c:13]([NH:17][CH2:18][CH2:19][O:20][CH3:21])[cH:14][cH:15][c:16]23)[cH:22][c:23]([OH:27])[c:24]([CH3:26])[cH:25]1

Participants

8

Reactant 6

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 212602754-(2-Fluoro-5-methoxycarbonyloxy-4-methylanilino)-7-(2-methoxyethylamino)quinazoline

Product 2

HCID 313Hydrochloric AcidHCID 212602824-Fluoro-5-[[7-(2-methoxyethylamino)quinazolin-4-yl]amino]-2-methylphenol

Sources & evidence

ORD record
ord-0b07a172f9914488bd2680b39235a5f6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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