Bromide ion → 1-Tert-butyl-2-(benzyloxy)-5-(trifluoromethyl)-4-nitrobenzene

HRID 1569419Notes

Reaction equation

HRID 1569419 reaction equation
[Br-:25].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:7][c:8]([N+:12](=[O:13])[O-:14])[c:9]([Br:11])[cH:10]1.[Cl:27][C:28]([C:29]([O:30][CH3:31])=[O:32])([F:33])[F:34].[Cu:36][I:37].[F-:23].[K+:24].[K+:26].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:7][c:8]([N+:12](=[O:13])[O-:14])[c:9]([C:28]([F:23])([F:33])[F:34])[cH:10]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 28179Fluoride IonHCID 73935Methyl chlorodifluoroacetateHCID 574702371-Tert-butyl-2-(benzyloxy)-5-bromo-4-nitrobenzene

Product 1

HCID 574702381-Tert-butyl-2-(benzyloxy)-5-(trifluoromethyl)-4-nitrobenzene

Sources & evidence

ORD record
ord-ce3863d3746c4e42ae2100296b28ac28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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