Bromide ion → 3-Bromo-5-(bromoacetyl)isoxazole

HRID 1151300Notes

Reaction equation

HRID 1151300 reaction equation
[Br-:10].[Br-:11].[Br-:12].[Br:1][c:2]1[n:3][o:4][c:5]([C:7]([CH3:8])=[O:9])[cH:6]1.[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[OH2:48].[c:13]1([N+:14]([CH3:15])([CH3:16])[CH3:17])[cH:18][cH:19][cH:20][cH:21][cH:22]1.[c:23]1([N+:24]([CH3:25])([CH3:26])[CH3:27])[cH:28][cH:29][cH:30][cH:31][cH:32]1.[c:33]1([N+:34]([CH3:35])([CH3:36])[CH3:37])[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[Br:1][c:2]1[n:3][o:4][c:5]([C:7]([CH2:8][Br:10])=[O:9])[cH:6]1

Participants

6

Reactant 5

HCID 259Bromide ion3×HCID 962WaterHCID 8028TetrahydrofuranHCID 15914Phenyltrimethylammonium3×HCID 136269711-(3-Bromo-1,2-oxazol-5-yl)ethan-1-one

Product 1

HCID 136269733-Bromo-5-(bromoacetyl)isoxazole

Sources & evidence

ORD record
ord-c2f9451e299c4425b74fd5233a419388
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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