Hydrochloric Acid → Hydrochloric Acid

HRID 1228818Notes

Reaction equation

HRID 1228818 reaction equation
[CH3:33][CH:34]([OH:35])[CH2:36][CH2:37][CH3:38].[Cl:2][c:3]1[cH:4][n:5][n:6][c:7]2[cH:8][c:9]([O:15][CH2:16][c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[c:10]([O:13][CH3:14])[cH:11][c:12]12.[ClH:1].[F:23][c:24]1[c:25]([NH2:26])[cH:27][c:28]([OH:32])[c:29]([CH3:31])[cH:30]1>>[ClH:2].[c:3]1([NH:26][c:25]2[c:24]([F:23])[cH:30][c:29]([CH3:31])[c:28]([OH:32])[cH:27]2)[cH:4][n:5][n:6][c:7]2[cH:8][c:9]([O:15][CH2:16][c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[c:10]([O:13][CH3:14])[cH:11][c:12]12

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 223862-PentanolHCID 101540985-Amino-4-fluoro-2-methylphenolHCID 219910124-Chloro-6-methoxy-7-(pyridin-4-ylmethoxy)cinnoline

Product 2

HCID 313Hydrochloric AcidHCID 219910564-Fluoro-5-[[6-methoxy-7-(pyridin-4-ylmethoxy)cinnolin-4-yl]amino]-2-methylphenol

Sources & evidence

ORD record
ord-d29ff95aecbb49349d6aa2293f458700
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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