Acetate → Methyl 4-(2,4-difluorophenyl)benzoate

HRID 111818Notes

Reaction equation

HRID 111818 reaction equation
[Br:14][c:15]1[c:16]([F:22])[cH:17][c:18]([F:21])[cH:19][cH:20]1.[C:1](=[O:2])([O:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([B:11]([OH:12])[OH:13])[cH:9][cH:10]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Na+:42].[Na+:43].[O-:44][C:45](=[O:46])[O-:47].[O-:55][C:56]([CH3:57])=[O:58].[O-:59][C:60]([CH3:61])=[O:62].[Pd+2:54].[c:23]1([P:24]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[C:1](=[O:2])([O:3][CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:15]2[c:16]([F:22])[cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ion2×HCID 8857Ethyl AcetateHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 676741-Bromo-2,4-difluorobenzeneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343694-Methoxycarbonylphenylboronic acid

Product 1

HCID 57771752Methyl 4-(2,4-difluorophenyl)benzoate

Sources & evidence

ORD record
ord-1200ba41255e41f0a44e4355ff9177ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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