Potassium Cation → Ethyl 1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

HRID 1556208Notes

Reaction equation

HRID 1556208 reaction equation
[C:15](=[O:16])([O-:17])[O-:18].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([C:11]([F:12])([F:13])[F:14])[n:8][nH:9][cH:10]1.[CH3:28][NH:29][CH:30]1[CH2:31][CH2:32][CH2:33][CH2:34][CH:35]1[NH:36][CH3:37].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[Cu:51][I:52].[I:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[K+:19].[K+:20]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([C:11]([F:12])([F:13])[F:14])[n:8][n:9](-[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[cH:10]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 1140TolueneHCID 8857Ethyl AcetateHCID 11575IodobenzeneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 5510741-N,2-N-dimethylcyclohexane-1,2-diamineHCID 178469923HCID 178469923, compound

Product 1

HCID 11448972Ethyl 1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

Sources & evidence

ORD record
ord-f0cff2c735a7464b94527e9c49f209b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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