Hydrochloric Acid → [1-(2-Carbamoyl-5-trifluoromethyl-phenyl)-piperidin-4-yl]-acetic acid

HRID 2141189Notes

Reaction equation

HRID 2141189 reaction equation
[CH3:32][S:33]([CH3:34])=[O:35].[CH3:36][OH:37].[ClH:21].[F:1][c:2]1[c:3]([C:4](=[O:5])[NH2:6])[cH:7][cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[cH:10]1.[K+:15].[K+:16].[NH:22]1[CH2:23][CH2:24][CH:25]([CH2:28][C:29](=[O:30])[OH:31])[CH2:26][CH2:27]1.[O-:17][C:18]([O-:19])=[O:20]>>[c:2]1([N:22]2[CH2:23][CH2:24][CH:25]([CH2:28][C:29](=[O:30])[OH:31])[CH2:26][CH2:27]2)[c:3]([C:4](=[O:5])[NH2:6])[cH:7][cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[cH:10]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 887MethanolHCID 19660Carbonate IonHCID 6056892-Fluoro-4-(trifluoromethyl)benzamideHCID 15125944-Piperidineacetic acid

Product 1

HCID 68442763[1-(2-Carbamoyl-5-trifluoromethyl-phenyl)-piperidin-4-yl]-acetic acid

Sources & evidence

ORD record
ord-ab6fb0baa36d4c53bcaf6079aeb355da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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