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Acetone → 7-(6-Chloropyrimidin-4-yloxy)isoquinoline-4-carboxylic acid

HRID 1144431
Notes
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Reaction equation

HRID 1144431 reaction equation
[CH3:25][C:26](=[O:27])[CH3:28].[Cl:17][c:18]1[n:19][cH:20][n:21][c:22]([Cl:24])[cH:23]1.[Na+:16].[OH-:15].[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:12](=[O:13])[OH:14])[cH:7][n:8][cH:9][c:10]2[cH:11]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([C:12](=[O:13])[OH:14])[cH:7][n:8][cH:9][c:10]2[cH:11]1)[c:22]1[n:21][cH:20][n:19][c:18]([Cl:17])[cH:23]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium IonHCID 961HydroxideHCID 709434,6-DichloropyrimidineHCID 574551797-Hydroxyisoquinoline-4-carboxylic acid

Product 1

HCID 574551767-(6-Chloropyrimidin-4-yloxy)isoquinoline-4-carboxylic acid

Sources & evidence

ORD record
ord-fea6ff159f984ffdaa84627b48840627
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes