Chloride → 4-methyl-1-(3-nitro-5-(trifluoromethyl)phenyl)-1H-imidazole

HRID 2347730Notes

Reaction equation

HRID 2347730 reaction equation
[Br:1][c:2]1[cH:3][c:4]([N+:12](=[O:13])[O-:14])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[C:21](=[O:22])([O-:23])[O-:24].[C:44]([O:45][CH:46]([CH3:47])[CH3:48])(=[O:49])[CH3:50].[CH3:15][c:16]1[n:17][cH:18][nH:19][cH:20]1.[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[CH3:36][O:37][C:38]([CH3:39])([CH3:40])[CH3:41].[Cl-:42].[Cu:51][I:52].[K+:25].[K+:26].[NH2:27][CH2:28][CH2:29][NH2:30].[Na+:43]>>[c:2]1(-[n:19]2[cH:18][n:17][c:16]([CH3:15])[cH:20]2)[cH:3][c:4]([N+:12](=[O:13])[O-:14])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1

Participants

12

Reactant 11

HCID 312ChlorideHCID 813Potassium Cation2×HCID 923Sodium ionHCID 3301EthylenediamineHCID 6228DimethylformamideHCID 7915Isopropyl AcetateHCID 15413tert-Butyl methyl etherHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 70154111-Bromo-3-nitro-5-(trifluoromethyl)benzeneHCID 178418800HCID 178418800, compound

Product 1

HCID 177482064-methyl-1-(3-nitro-5-(trifluoromethyl)phenyl)-1H-imidazole

Sources & evidence

ORD record
ord-c001a538b9f943df987575cae64e80d9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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