Ammonium → 3-Amino-4-hydroxybenzonitrile

HRID 664239Notes

Reaction equation

HRID 664239 reaction equation
[CH2:19]1[O:20][CH2:21][CH2:22][CH2:23]1.[CH3:16][CH2:17][OH:18].[CH3:24][CH2:25][O:26][C:27]([CH3:28])=[O:29].[Cl-:13].[Fe:30].[NH4+:14].[OH2:15].[OH:1][c:2]1[c:3]([N+:10]([O-:11])=[O:12])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1>>[OH:1][c:2]1[c:3]([NH2:10])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 702EthanolHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 23925IronHCID 767584-Hydroxy-3-nitrobenzonitrile

Product 1

HCID 2712583-Amino-4-hydroxybenzonitrile

Sources & evidence

ORD record
ord-e1bb092c2407413e87b8146335b43073
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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