Potassium Cation → 1-(Propan-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

HRID 299743Notes

Reaction equation

HRID 299743 reaction equation
[Br:16][c:17]1[cH:18][n:19][nH:20][cH:21]1.[Br:1][c:2]1[cH:3][n:4][n:5]([CH:7]([CH3:8])[CH3:9])[cH:6]1.[C:10](=[O:11])([O-:12])[O-:13].[CH2:26]([n:27]1[cH:28][c:29]([B:33]2[O:34][C:35]([CH3:40])([CH3:41])[C:36]([CH3:38])([CH3:39])[O:37]2)[cH:30][n:31]1)[CH3:32].[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[I:22][CH:23]([CH3:24])[CH3:25].[K+:14].[K+:15].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[c:2]1([B:33]2[O:34][C:35]([CH3:40])([CH3:41])[C:36]([CH3:38])([CH3:39])[O:37]2)[cH:3][n:4][n:5]([CH:7]([CH3:8])[CH3:9])[cH:6]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 6362Isopropyl iodideHCID 8857Ethyl AcetateHCID 163754-BromopyrazoleHCID 19660Carbonate IonHCID 113790451-Ethyl-1H-pyrazole-4-boronic acid, pinacol esterHCID 223292004-Bromo-1-isopropyl-1H-pyrazole

Product 1

HCID 467380211-(Propan-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Sources & evidence

ORD record
ord-cb73d147f3004653afb17bdb09db8205
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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