Acetate → Methyl 3-cyano-4-hydroxybenzoate

HRID 1132707Notes

Reaction equation

HRID 1132707 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[O:7][CH3:8])[cH:9][cH:10][c:11]1[OH:12].[C:25]([O-:26])(=[O:27])[CH3:28].[C:30]([O-:31])(=[O:32])[CH3:33].[CH3:19][N:20]([CH3:21])[C:22](=[O:23])[CH3:24].[Na+:13].[Na+:14].[O-:15][C:16](=[O:17])[O-:18].[Pd+2:29]>>[c:2]1([C:19]#[N:20])[cH:3][c:4]([C:5](=[O:6])[O:7][CH3:8])[cH:9][cH:10][c:11]1[OH:12]

Participants

7

Reactant 6

HCID 175Acetate2×HCID 923Sodium ion2×HCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 4778958Methyl 3-bromo-4-hydroxybenzoate

Product 1

HCID 11769089Methyl 3-cyano-4-hydroxybenzoate

Sources & evidence

ORD record
ord-d1b9dad550c0424c8ef1553deeb26116
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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