Acetate → Methyl 2'-chloro-1,1'-biphenyl-4-carboxylate

HRID 199382Notes

Reaction equation

HRID 199382 reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([Br:10])[cH:8][cH:9]1)=[O:11].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[Cl:12][c:13]1[c:14]([B:19]([OH:20])[OH:21])[cH:15][cH:16][cH:17][cH:18]1.[Na+:22].[Na+:23].[O-:24][C:25](=[O:26])[O-:27].[O-:60][C:61]([CH3:62])=[O:63].[O-:64][C:65]([CH3:66])=[O:67].[OH2:52].[Pd+2:59].[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]([c:4]1[cH:5][cH:6][c:7](-[c:14]2[c:13]([Cl:12])[cH:18][cH:17][cH:16][cH:15]2)[cH:8][cH:9]1)=[O:11]

Participants

11

Reactant 10

HCID 175Acetate2×HCID 923Sodium ion2×HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 11776TriphenylphosphineHCID 12081Methyl 4-bromobenzoateHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343222-Chlorophenylboronic acid

Product 1

HCID 1393555Methyl 2'-chloro-1,1'-biphenyl-4-carboxylate

Sources & evidence

ORD record
ord-6d246ffa4d4a481fbdeb04136a74d150
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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