Potassium Cation → 2,2,2-Trifluoro-1-[2-(3-phenyl-pyrazol-1-yl)-phenyl]-ethanol

HRID 106746Notes

Reaction equation

HRID 106746 reaction equation
[CH3:31][NH:32][CH:33]1[CH2:34][CH2:35][CH2:36][CH2:37][CH:38]1[NH:39][CH3:40].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[Cu:47][I:48].[F:1][C:2]([CH:3]([OH:4])[c:5]1[c:6]([I:11])[cH:7][cH:8][cH:9][cH:10]1)([F:12])[F:13].[K+:25].[K+:26].[O-:27][C:28]([O-:29])=[O:30].[c:14]1(-[c:20]2[n:21][nH:22][cH:23][cH:24]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[F:1][C:2]([CH:3]([OH:4])[c:5]1[c:6](-[n:22]2[n:21][c:20](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[cH:24][cH:23]2)[cH:7][cH:8][cH:9][cH:10]1)([F:12])[F:13]

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 1140TolueneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 5510741-N,2-N-dimethylcyclohexane-1,2-diamineHCID 667436982-Iodo-alpha-(trifluoromethyl)benzyl AlcoholHCID 178420101HCID 178420101, compound

Product 1

HCID 667436442,2,2-Trifluoro-1-[2-(3-phenyl-pyrazol-1-yl)-phenyl]-ethanol

Sources & evidence

ORD record
ord-fe9242612bbc4770be7ad901fdda61d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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