Sodium ion → 6-(4-(Methylsulfonyl)phenyl)pyridin-3-ol

HRID 1572123Notes

Reaction equation

HRID 1572123 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([OH:8])[cH:6][n:7]1.[C:22](=[O:23])([O-:24])[O-:25].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[CH3:9][S:10](=[O:11])(=[O:12])[c:13]1[cH:14][cH:15][c:16]([B:19]([OH:20])[OH:21])[cH:17][cH:18]1.[Na+:26].[Na+:27].[O:28]=[CH:29][N:30]([CH3:31])[CH3:32].[OH2:39].[Pd:40]([Cl:41])[Cl:42].[c:43]1([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58][cH:59][cH:60][cH:61]1.[c:62]1([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[cH:76][cH:77][cH:78][cH:79][cH:80]1>>[c:2]1(-[c:16]2[cH:15][cH:14][c:13]([S:10]([CH3:9])(=[O:11])=[O:12])[cH:18][cH:17]2)[cH:3][cH:4][c:5]([OH:8])[cH:6][n:7]1

Participants

10

Reactant 9

HCID 923Sodium ion2×HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 27343644-(Methanesulfonyl)phenylboronic acidHCID 27628652-Bromo-5-hydroxypyridine

Product 1

HCID 532295926-(4-(Methylsulfonyl)phenyl)pyridin-3-ol

Sources & evidence

ORD record
ord-ecea88ff391246afba14ba813c563746
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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