Bicarbonate Ion → 7-chloro-1H-indazole-5-carbaldehyde

HRID 1549129Notes

Reaction equation

HRID 1549129 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[cH:5][n:6][nH:7][c:8]2[c:9]([Cl:11])[cH:10]1.[C:14]([Li:15])([CH3:16])([CH3:17])[CH3:18].[C:30]([O-:31])(=[O:32])[OH:33].[CH3:19][CH2:20][CH2:21][CH2:22][CH3:23].[CH3:35][OH:36].[CH3:38][CH2:39][O:40][CH2:41][CH3:42].[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[H-:12].[K+:29].[Na+:13].[Na+:34].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:37].[S:24]([O-:25])([OH:26])(=[O:27])=[O:28]>>[c:2]1([CH:30]=[O:31])[cH:3][c:4]2[cH:5][n:6][nH:7][c:8]2[c:9]([Cl:11])[cH:10]1

Participants

14

Reactant 13

HCID 769Bicarbonate IonHCID 813Potassium CationHCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 8003PentaneHCID 8028TetrahydrofuranHCID 61778Sulfate, hydrogenHCID 166653HydrideHCID 211021945-Bromo-7-chloro-1H-indazoleHCID 178418306HCID 178418306, compound

Product 1

HCID 211022107-chloro-1H-indazole-5-carbaldehyde

Sources & evidence

ORD record
ord-a9dd485ec3494f3793720da775200783
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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