Acetonitrile → 1-(4-Chloro-2-nitrophenyl)-2-isopropyl-1H-imidazole

HRID 2151008Notes

Reaction equation

HRID 2151008 reaction equation
[CH3:29][C:30]#[N:31].[CH:12]([CH3:13])([CH3:14])[c:15]1[nH:16][cH:17][cH:18][n:19]1.[CH:20]([N:21]([CH2:22][CH3:23])[CH:24]([CH3:25])[CH3:26])([CH3:27])[CH3:28].[Cl:1][c:2]1[cH:3][c:4]([N+:9](=[O:10])[O-:11])[c:5]([F:8])[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][c:4]([N+:9](=[O:10])[O-:11])[c:5](-[n:16]2[c:15]([CH:12]([CH3:13])[CH3:14])[n:19][cH:18][cH:17]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 676604-Chloro-1-fluoro-2-nitrobenzeneHCID 81531DiisopropylethylamineHCID 1234571H-Imidazole, 2-(1-methylethyl)-

Product 1

HCID 591988521-(4-Chloro-2-nitrophenyl)-2-isopropyl-1H-imidazole

Sources & evidence

ORD record
ord-33bda9332c4843c88ffbf93a5eda6be7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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