Acetate → 5-Fluoro[1,1'-biphenyl]-3-ol

HRID 2132659Notes

Reaction equation

HRID 2132659 reaction equation
[CH3:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31].[F:1][c:2]1[cH:3][c:4]([OH:9])[cH:5][c:6]([I:8])[cH:7]1.[Na+:19].[Na+:20].[O-:21][C:22](=[O:23])[O-:24].[O-:34][C:35]([CH3:36])=[O:37].[O-:38][C:39]([CH3:40])=[O:41].[OH2:32].[OH:10][B:11]([OH:12])[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[Pd+2:33]>>[F:1][c:2]1[cH:3][c:4]([OH:9])[cH:5][c:6](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:7]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ion2×HCID 962WaterHCID 8900HeptaneHCID 19660Carbonate IonHCID 66827Phenylboronic AcidHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 668822513-fluoro-5-iodophenol

Product 1

HCID 233702025-Fluoro[1,1'-biphenyl]-3-ol

Sources & evidence

ORD record
ord-f10e3a82368245289ee56d77cc390419
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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