Hydrochloric Acid → Hydrochloric Acid

HRID 294162Notes

Reaction equation

HRID 294162 reaction equation
[CH3:29][CH2:30][OH:31].[CH3:32][OH:33].[ClH:1].[F:2][c:3]1[c:4]([NH:5][c:6]2[n:7][cH:8][n:9][c:10]3[cH:11][c:12]([N+:16]([O-:17])=[O:18])[cH:13][cH:14][c:15]23)[cH:19][c:20]([O:24][C:25](=[O:26])[O:27][CH3:28])[c:21]([CH3:23])[cH:22]1>>[ClH:1].[F:2][c:3]1[c:4]([NH:5][c:6]2[n:7][cH:8][n:9][c:10]3[cH:11][c:12]([NH2:16])[cH:13][cH:14][c:15]23)[cH:19][c:20]([O:24][C:25](=[O:26])[O:27][CH3:28])[c:21]([CH3:23])[cH:22]1

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 887MethanolHCID 22625048[4-Fluoro-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl carbonate

Product 2

HCID 313Hydrochloric AcidHCID 22625085[5-[(7-Aminoquinazolin-4-yl)amino]-4-fluoro-2-methylphenyl] methyl carbonate

Sources & evidence

ORD record
ord-2a599cde0b4f43a08497bd4f6df462c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…