Potassium Cation → HCID 46179269, compound

HRID 1567734Notes

Reaction equation

HRID 1567734 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]([CH2:10][c:11]3[cH:12][c:13](-[c:17]4[n:18][cH:19][c:20]([O:23][CH2:24][CH2:25][N:26]5[CH2:27][CH2:28][O:29][CH2:30][CH2:31]5)[cH:21][n:22]4)[cH:14][cH:15][cH:16]3)[n:8][n:9]2)[cH:32]1.[CH3:33][n:34]1[n:35][cH:36][c:37]([B:39]2[O:40][C:41]([CH3:42])([CH3:43])[C:44]([CH3:45])([CH3:46])[O:47]2)[cH:38]1.[CH3:59][O:60][CH2:61][CH2:62][O:63][CH3:64].[K+:56].[K+:57].[K+:58].[OH2:48].[OH2:49].[OH2:50].[P:51]([O-:52])([O-:53])([O-:54])=[O:55]>>[c:2]1(-[c:37]2[cH:36][n:35][n:34]([CH3:33])[cH:38]2)[cH:3][cH:4][c:5]2[c:6]([n:7]([CH2:10][c:11]3[cH:12][c:13](-[c:17]4[n:18][cH:19][c:20]([O:23][CH2:24][CH2:25][N:26]5[CH2:27][CH2:28][O:29][CH2:30][CH2:31]5)[cH:21][n:22]4)[cH:14][cH:15][cH:16]3)[n:8][n:9]2)[cH:32]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 962Water3×HCID 1061PhosphateHCID 80711,2-DimethoxyethaneHCID 27739871-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleHCID 58289712HCID 58289712, compound

Product 1

HCID 46179269HCID 46179269, compound

Sources & evidence

ORD record
ord-024461c0fe30497088196621f4b15ec7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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