Isopropanol → Hydrochloric Acid

HRID 101796Notes

Reaction equation

HRID 101796 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:20][CH3:21])[cH:11][c:12]2[c:13]([Cl:19])[n:14][cH:15][n:16][c:17]2[cH:18]1.[CH3:31][CH:32]([OH:33])[CH3:34].[Cl:22][c:23]1[cH:24][c:25]([F:30])[c:26]([NH2:27])[cH:28][cH:29]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:20][CH3:21])[cH:11][c:12]2[c:13]([NH:27][c:26]3[c:25]([F:30])[cH:24][c:23]([Cl:22])[cH:29][cH:28]3)[n:14][cH:15][n:16][c:17]2[cH:18]1.[ClH:19]

Participants

5

Reactant 3

HCID 3776IsopropanolHCID 938984-Chloro-2-fluoroanilineHCID 106619987-(Benzyloxy)-4-chloro-6-methoxyquinazoline

Product 2

HCID 313Hydrochloric AcidHCID 105016877-Benzyloxy-4-(4-chloro-2-fluorophenylamino)-6-methoxyquinazoline

Sources & evidence

ORD record
ord-0ac2eb3a58ea4698a0845536fa994752
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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