Potassium Cation → 2,4-Difluoro-5-nitrobenzonitrile

HRID 98117

Reaction equation

HRID 98117 reaction equation
[F:11][c:12]1[c:13]([C:14]#[N:15])[cH:16][cH:17][c:18]([F:20])[cH:19]1.[K+:1].[O-:2][N+:3]([O-:4])=[O:5].[S:6](=[O:7])(=[O:8])([OH:9])[OH:10]>>[O-:2][N+:3](=[O:5])[c:17]1[cH:16][c:13]([C:14]#[N:15])[c:12]([F:11])[cH:19][c:18]1[F:20]

Participants

5

Reactant 4

HCID 813Potassium CationHCID 943NitrateHCID 1118Sulfuric AcidHCID 775452,4-Difluorobenzonitrile

Product 1

HCID 118197152,4-Difluoro-5-nitrobenzonitrile

Sources & evidence

ORD record
ord-76fb21409fd848e090be3ba983c19d34
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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