Potassium Cation → 2-Bromo-4-chloro-6-fluorobenzonitrile

HRID 204755Notes

Reaction equation

HRID 204755 reaction equation
[Br:1][c:2]1[c:3]([NH2:10])[c:4]([F:9])[cH:5][c:6]([Cl:8])[cH:7]1.[C-:18]#[N:19].[Cl:32][CH2:33][Cl:34].[F:11][B-:12]([F:13])([F:14])[F:15].[K+:20].[N:16]#[O+:17].[OH2:21].[OH2:22].[OH2:23].[OH2:24].[OH2:25].[OH2:26].[S:27]([OH:28])([OH:29])(=[O:30])=[O:31]>>[Br:1][c:2]1[c:3]([C:18]#[N:19])[c:4]([F:9])[cH:5][c:6]([Cl:8])[cH:7]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 962Water6×HCID 1118Sulfuric AcidHCID 5975CyanideHCID 6344DichloromethaneHCID 26255TetrafluoroborateHCID 84878AzanylidyneoxidaniumHCID 27362222-Bromo-4-chloro-6-fluoroaniline

Product 1

HCID 585795372-Bromo-4-chloro-6-fluorobenzonitrile

Sources & evidence

ORD record
ord-e3d463b3192d4630a65bdd3bbe1ad7d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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