Acetate → 5-(6-Chloro-pyridin-3-yl)-2,4-dimethoxy-pyrimidine

HRID 166823Notes

Reaction equation

HRID 166823 reaction equation
[C:22](=[O:23])([O-:24])[O-:25].[CH3:1][O:2][c:3]1[n:4][cH:5][c:6]([B:11]([OH:12])[OH:13])[c:7]([O:9][CH3:10])[n:8]1.[Cl:14][c:15]1[n:16][cH:17][c:18]([I:21])[cH:19][cH:20]1.[Na+:26].[Na+:27].[O-:48][C:49]([CH3:50])=[O:51].[O-:52][C:53]([CH3:54])=[O:55].[Pd+2:47].[c:28]1([P:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[CH3:1][O:2][c:3]1[n:4][cH:5][c:6](-[c:18]2[cH:17][n:16][c:15]([Cl:14])[cH:20][cH:19]2)[c:7]([O:9][CH3:10])[n:8]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 923Sodium ion2×HCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2736209(2,4-Dimethoxypyrimidin-5-yl)boronic acidHCID 43971762-Chloro-5-iodopyridine

Product 1

HCID 589942255-(6-Chloro-pyridin-3-yl)-2,4-dimethoxy-pyrimidine

Sources & evidence

ORD record
ord-d0381410271e487eb6cd116bfed0074f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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