Bromide ion → Diclofenac

HRID 1223177Notes

Reaction equation

HRID 1223177 reaction equation
[Br-:10].[Br:17][c:18]1[c:19]([CH2:24][C:25](=[O:26])[O-:27])[cH:20][cH:21][cH:22][cH:23]1.[C:11](=[O:12])([O-:13])[O-:14].[CH3:41][S:42](=[O:43])[CH3:44].[Cl:29][c:30]1[cH:31][cH:32][cH:33][cH:34][c:35]1[CH2:36][C:37]([O-:38])=[O:39].[K+:15].[K+:16].[K+:28].[K+:40].[NH2:1][c:2]1[c:3]([Cl:4])[cH:5][cH:6][cH:7][c:8]1[Cl:9]>>[NH:1]([c:2]1[c:3]([Cl:4])[cH:5][cH:6][cH:7][c:8]1[Cl:9])[c:18]1[c:19]([CH2:24][C:25](=[O:26])[OH:27])[cH:20][cH:21][cH:22][cH:23]1

Participants

8

Reactant 7

HCID 259Bromide ionHCID 679Dimethyl SulfoxideHCID 813Potassium Cation4×HCID 118462,6-DichloroanilineHCID 19660Carbonate IonHCID 4740735HCID 4740735, compoundHCID 6931493HCID 6931493, compound

Product 1

HCID 3033Diclofenac

Sources & evidence

ORD record
ord-3f67bccc50cb42d18f66ce7f0c79dca4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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