Acetate → Methyl 4-hydroxy-[1,1'-biphenyl]-3-carboxylate

HRID 125442Notes

Reaction equation

HRID 125442 reaction equation
[Br:10][c:11]1[cH:12][cH:13][c:14]([OH:21])[c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20]1.[C:23](=[O:24])([O-:25])[O-:26].[CH3:29][C:30](=[O:31])[CH3:32].[K+:27].[K+:28].[O-:34][C:35]([CH3:36])=[O:37].[O-:38][C:39]([CH3:40])=[O:41].[OH2:22].[OH:1][B:2]([OH:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[Pd+2:33].[Pd:42]>>[c:4]1(-[c:11]2[cH:12][cH:13][c:14]([OH:21])[c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20]2)[cH:5][cH:6][cH:7][cH:8][cH:9]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 180AcetoneHCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 23938PalladiumHCID 66827Phenylboronic AcidHCID 77683Methyl 5-bromosalicylateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

Product 1

HCID 3312033Methyl 4-hydroxy-[1,1'-biphenyl]-3-carboxylate

Sources & evidence

ORD record
ord-cb0aa4310c914ea7b9e633813e64098c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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