Isopropanol → Hydrochloric Acid

HRID 1118103Notes

Reaction equation

HRID 1118103 reaction equation
[CH:28]([OH:29])([CH3:30])[CH3:31].[Cl:1][c:2]1[cH:3][n:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][CH2:16][O:17][CH3:18])[c:9]([O:12][CH3:13])[cH:10][c:11]12.[O:32]=[CH:33][N:34]([CH3:35])[CH3:36].[OH:19][c:20]1[cH:21][c:22]([NH2:23])[cH:24][cH:25][c:26]1[CH3:27]>>[ClH:1].[c:2]1([NH:23][c:22]2[cH:21][c:20]([OH:19])[c:26]([CH3:27])[cH:25][cH:24]2)[cH:3][n:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][CH2:16][O:17][CH3:18])[c:9]([O:12][CH3:13])[cH:10][c:11]12

Participants

6

Reactant 4

HCID 3776IsopropanolHCID 6228DimethylformamideHCID 178185-Amino-2-methylphenolHCID 107070484-Chloro-6-methoxy-7-(2-methoxyethoxy)cinnoline

Product 2

HCID 313Hydrochloric AcidHCID 219910154-(3-Hydroxy-4-methylanilino)-6-methoxy-7-(2-methoxyethoxy)cinnoline

Sources & evidence

ORD record
ord-60149c5b77104e2999a82e2c6c183d22
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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