Hydrochloric Acid → 6-iodo-1H-indazole

HRID 671159Notes

Reaction equation

HRID 671159 reaction equation
[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36].[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[ClH:30].[I-:16].[K+:15].[N:1]([O-:2])=[O:3].[NH2:5][c:6]1[cH:7][cH:8][c:9]2[cH:10][n:11][nH:12][c:13]2[cH:14]1.[Na+:21].[Na+:23].[Na+:4].[O:25]=[CH:26][N:27]([CH3:28])[CH3:29].[OH-:22].[OH2:24].[S:17](=[O:18])([OH:19])[O-:20]>>[c:6]1([I:16])[cH:7][cH:8][c:9]2[cH:10][n:11][nH:12][c:13]2[cH:14]1

Participants

13

Reactant 12

HCID 313Hydrochloric AcidHCID 813Potassium CationHCID 923Sodium ion3×HCID 946NitriteHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 30165Iodide IonHCID 814231H-Indazol-6-amineHCID 104748Bisulfite

Product 1

HCID 129912416-iodo-1H-indazole

Sources & evidence

ORD record
ord-2c64998e46994047b30f8ec9a9f62610
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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