Calcium Cation → 5-Fluoro-2-nitrophenol

HRID 1238946Notes

Reaction equation

HRID 1238946 reaction equation
[Ca+2:20].[F:1][c:2]1[c:3]([N+:9](=[O:10])[O-:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1.[K+:13].[OH-:12].[OH-:19].[OH-:21].[OH2:22].[S:14]([OH:15])(=[O:16])(=[O:17])[OH:18]>>[c:2]1([OH:15])[c:3]([N+:9](=[O:10])[O-:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

7

Reactant 6

HCID 271Calcium CationHCID 813Potassium CationHCID 961Hydroxide3×HCID 962WaterHCID 1118Sulfuric AcidHCID 679672,4-Difluoronitrobenzene

Product 1

HCID 99375-Fluoro-2-nitrophenol

Sources & evidence

ORD record
ord-280726aa2447464faefb0bf3ce0cdcc4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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