Methanol → 1-Benzyl-4-bromo-5-(3,5-difluoro-phenyl)-2-(2,4-difluoro-phenyl)-imidazole

HRID 180331Notes

Reaction equation

HRID 180331 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9](-[c:15]2[c:16]([F:22])[cH:17][c:18]([F:21])[cH:19][cH:20]2)[n:10][c:11]([Br:14])[c:12]1[Br:13].[CH3:40][OH:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[F:23][c:24]1[cH:25][c:26]([B:31]([OH:32])[OH:33])[cH:27][c:28]([F:30])[cH:29]1.[Na+:34].[Na+:35].[O-:36][C:37](=[O:38])[O-:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9](-[c:15]2[c:16]([F:22])[cH:17][c:18]([F:21])[cH:19][cH:20]2)[n:10][c:11]([Br:14])[c:12]1-[c:26]1[cH:25][c:24]([F:23])[cH:29][c:28]([F:30])[cH:27]1

Participants

8

Reactant 7

HCID 887MethanolHCID 923Sodium ion2×HCID 1140TolueneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 2734338(3,5-Difluorophenyl)boronic acidHCID 17981678HCID 17981678, compound

Product 1

HCID 179816431-Benzyl-4-bromo-5-(3,5-difluoro-phenyl)-2-(2,4-difluoro-phenyl)-imidazole

Sources & evidence

ORD record
ord-1ba48b57a18a42078e01f77ea0e6ce72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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