Bicarbonate Ion → 2,4-bis-(methyloxy)-5-(1-methyl-1H-pyrazol-4-yl)pyrimidine

HRID 319349

Reaction equation

HRID 319349 reaction equation
[Br:1][c:2]1[c:3]([O:10][CH3:11])[n:4][c:5]([O:8][CH3:9])[n:6][cH:7]1.[CH3:12][n:13]1[n:14][cH:15][c:16]([B:18]2[O:19][C:20]([CH3:21])([CH3:22])[C:23]([CH3:24])([CH3:25])[O:26]2)[cH:17]1.[CH3:32][O:33][CH2:34][CH2:35][O:36][CH3:37].[Na+:31].[O-:27][C:28]([OH:29])=[O:30].[OH2:38]>>[c:2]1(-[c:16]2[cH:15][n:14][n:13]([CH3:12])[cH:17]2)[c:3]([O:10][CH3:11])[n:4][c:5]([O:8][CH3:9])[n:6][cH:7]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 2557195-Bromo-2,4-dimethoxypyrimidineHCID 27739871-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Product 1

HCID 594483652,4-bis-(methyloxy)-5-(1-methyl-1H-pyrazol-4-yl)pyrimidine

Sources & evidence

ORD record
ord-4d6472021c94473dbd978ea8c1c28637
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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