Potassium Cation → Ibuprofen, (+-)-

HRID 1123565Notes

Reaction equation

HRID 1123565 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][c:5]([CH2:6][C:7]([O:8][CH3:9])=[O:10])[cH:11][cH:12]1)[CH:13]([CH3:14])[CH3:15].[CH2:28]([CH:29]([CH3:30])[CH3:31])[c:32]1[cH:33][cH:34][c:35]([CH:38]([C:39](=[O:40])[O:41][CH3:42])[CH3:43])[cH:36][cH:37]1.[CH3:16][O:17][C:18]([O:19][CH3:20])=[O:21].[K+:22].[K+:23].[O-:24][C:25]([O-:26])=[O:27]>>[CH2:28]([CH:29]([CH3:30])[CH3:31])[c:32]1[cH:33][cH:34][c:35]([CH:38]([C:39](=[O:40])[OH:41])[CH3:43])[cH:36][cH:37]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 12021Dimethyl CarbonateHCID 19660Carbonate IonHCID 109101Ibuprofen methyl esterHCID 10987436Methyl 2-(4-isobutylphenyl)acetate

Product 1

HCID 3672Ibuprofen, (+-)-

Sources & evidence

ORD record
ord-a9a632938287461a87330e90143e4c71
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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