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

HRID 1222790Notes

Reaction equation

HRID 1222790 reaction equation
[C:22](=[O:23])([O-:24])[O-:25].[CH3:1][O:2][c:3]1[n:4][cH:5][c:6]([I:11])[c:7]([O:9][CH3:10])[n:8]1.[Cl:12][c:13]1[n:14][cH:15][cH:16][cH:17][c:18]1[B:19]([OH:20])[OH:21].[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[c:13]([Cl:12])[n:14][cH:15][cH:16][cH:17]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 2634165-Iodo-2,4-dimethoxypyrimidineHCID 2762704(2-Chloropyridin-3-yl)boronic acid

Product 1

HCID 589942445-(2-Chloro-pyridin-3-yl)-2,4-dimethoxy-pyrimidine

Sources & evidence

ORD record
ord-244da1bd2fd449d7bd22df89b5b8660f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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