Bromide ion → Methyl 4-Bromo-3-hydroxybenzoate

HRID 165969Notes

Reaction equation

HRID 165969 reaction equation
[Br-:18].[Cu+2:36].[N:13]([O-:14])=[O:15].[NH2:1][c:2]1[c:3]([OH:12])[cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1.[Na+:16].[Na+:17].[Na+:23].[Na+:24].[OH2:25].[OH2:26].[OH2:27].[OH2:28].[OH2:29].[OH2:30].[S:19]([O-:20])([O-:21])=[O:22].[S:31]([O-:32])([O-:33])(=[O:34])=[O:35]>>[c:2]1([Br:18])[c:3]([OH:12])[cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 923Sodium ion4×HCID 946NitriteHCID 962Water6×HCID 1099SulfiteHCID 1117Sulfate IonHCID 27099Cupric cationHCID 7020619Benzoic acid, 4-amino-3-hydroxy-, methyl ester

Product 1

HCID 6425184Methyl 4-Bromo-3-hydroxybenzoate

Sources & evidence

ORD record
ord-12542d59992d470cb80f6d61c2b0ff47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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