Acetone → 5-((6-Chloropyrimidin-4-yl)oxy)-1H-indole

HRID 162333

Reaction equation

HRID 162333 reaction equation
[CH3:26][CH2:27][O:28][C:29]([CH3:30])=[O:31].[CH3:4][C:5]([CH3:6])=[O:7].[Cl:8][c:9]1[n:10][cH:11][n:12][c:13]([Cl:15])[cH:14]1.[Na+:2].[OH-:1].[OH2:32].[OH2:3].[OH:16][c:17]1[cH:18][c:19]2[cH:20][cH:21][nH:22][c:23]2[cH:24][cH:25]1>>[c:9]1([O:16][c:17]2[cH:18][c:19]3[cH:20][cH:21][nH:22][c:23]3[cH:24][cH:25]2)[n:10][cH:11][n:12][c:13]([Cl:15])[cH:14]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 962Water2×HCID 8857Ethyl AcetateHCID 160545-HydroxyindoleHCID 709434,6-Dichloropyrimidine

Product 1

HCID 574551565-((6-Chloropyrimidin-4-yl)oxy)-1H-indole

Sources & evidence

ORD record
ord-abb98dfd454a492dbcf5379cd96a6ca9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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