Acetate → Methyl 2-(benzyloxy)-6-phenylisonicotinate

HRID 1138083Notes

Reaction equation

[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[Cl:12][c:13]1[n:14][c:15]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:16][c:17]([C:19](=[O:20])[O:21][CH3:22])[cH:18]1.[F-:10].[K+:11].[O-:32][C:33]([CH3:34])=[O:35].[O-:36][C:37]([CH3:38])=[O:39].[OH:1][B:2]([OH:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[Pd+2:31]>>[c:4]1(-[c:13]2[n:14][c:15]([O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:16][c:17]([C:19](=[O:20])[O:21][CH3:22])[cH:18]2)[cH:5][cH:6][cH:7][cH:8][cH:9]1

Participants

Reactant 7

HCID 175Acetate2×

HCID 813Potassium Cation

HCID 8028Tetrahydrofuran

HCID 28179Fluoride Ion

HCID 66827Phenylboronic Acid

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

HCID 57930944Methyl 2-(benzyloxy)-6-chloroisonicotinate

Product 1

HCID 57930997Methyl 2-(benzyloxy)-6-phenylisonicotinate

Sources & evidence

ORD record: ord-dc874e6c1c404a0bbcf79ef95f217531
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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