Potassium Cation → 2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)acetonitrile

Reaction equation

[C:17](=[O:18])([O-:19])[O-:20].[CH3:1][C:2]1([CH3:14])[O:3][B:4]([c:9]2[cH:10][n:11][nH:12][cH:13]2)[O:5][C:6]1([CH3:7])[CH3:8].[CH3:24][C:25]#[N:26].[I-:16].[K+:21].[K+:22].[Na+:15].[OH2:23]>>[CH3:1][C:2]1([CH3:14])[O:3][B:4]([c:9]2[cH:10][n:11]([CH2:24][C:25]#[N:26])[n:12][cH:13]2)[O:5][C:6]1([CH3:7])[CH3:8]

Participants

Reactant 7

HCID 813Potassium Cation2×

HCID 923Sodium Ion

HCID 962Water

HCID 6342Acetonitrile

HCID 19660Carbonate Ion

HCID 30165Iodide Ion

HCID 27740104-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Product 1

HCID 674680952-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)acetonitrile

Sources & evidence

ORD record: ord-10b4b1374fbe42fa878d5f97f2a41eb1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…