Acetate → 2,4-Dimethoxy-5-pyrazin-2-yl-pyrimidine

HRID 288726Notes

Reaction equation

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

Participants

Reactant 7

HCID 175Acetate2×

HCID 923Sodium ion2×

HCID 11776Triphenylphosphine

HCID 19660Carbonate Ion

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

HCID 642841Iodopyrazine

HCID 2736209(2,4-Dimethoxypyrimidin-5-yl)boronic acid

Product 1

HCID 589942062,4-Dimethoxy-5-pyrazin-2-yl-pyrimidine

Sources & evidence

ORD record: ord-cf6a63a1fbd14f648d0b7149f76879a1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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