Hydrochloric Acid → Hydrochloric Acid

HRID 195617Notes

Reaction equation

HRID 195617 reaction equation
[CH:32]([OH:33])([CH3:34])[CH3:35].[Cl:2][c:3]1[n:4][cH:5][n:6][c:7]2[cH:8][c:9]([N+:15](=[O:16])[O-:17])[c:10]([O:13][CH3:14])[cH:11][c:12]12.[ClH:1].[F:18][c:19]1[c:20]([NH2:21])[cH:22][c:23]([O:27][C:28](=[O:29])[O:30][CH3:31])[c:24]([CH3:26])[cH:25]1>>[ClH:2].[c:3]1([NH:21][c:20]2[c:19]([F:18])[cH:25][c:24]([CH3:26])[c:23]([O:27][C:28](=[O:29])[O:30][CH3:31])[cH:22]2)[n:4][cH:5][n:6][c:7]2[cH:8][c:9]([N+:15](=[O:16])[O-:17])[c:10]([O:13][CH3:14])[cH:11][c:12]12

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 3776IsopropanolHCID 106337504-Chloro-6-methoxy-7-nitroquinazolineHCID 226250465-Amino-4-fluoro-2-methylphenyl Methoxyformate

Product 2

HCID 313Hydrochloric AcidHCID 10644785[4-Fluoro-5-[(6-methoxy-7-nitroquinazolin-4-yl)amino]-2-methylphenyl] methyl carbonate

Sources & evidence

ORD record
ord-95373e27539c4b5da9d85fd9ed343110
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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