Potassium Cation → N-[2-(3-bromo-5-nitrophenyl)-1-hydroxypropan-2-yl]-2-chloroacetamide

HRID 312676Notes

Reaction equation

HRID 312676 reaction equation
[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH:22]([N:23]([CH2:24][CH3:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[Cl:31][CH2:32][C:33](=[O:34])[Cl:35].[K+:16].[K+:17].[NH2:1][C:2]([CH2:3][OH:4])([CH3:5])[c:6]1[cH:7][c:8]([Br:15])[cH:9][c:10]([N+:12](=[O:13])[O-:14])[cH:11]1.[O-:18][C:19]([O-:20])=[O:21].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40].[OH2:48]>>[NH:1]([C:2]([CH2:3][OH:4])([CH3:5])[c:6]1[cH:7][c:8]([Br:15])[cH:9][c:10]([N+:12](=[O:13])[O-:14])[cH:11]1)[C:33]([CH2:32][Cl:31])=[O:34]

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 6228DimethylformamideHCID 6577Chloroacetyl chlorideHCID 19660Carbonate IonHCID 81531DiisopropylethylamineHCID 66665532HCID 66665532, compound

Product 1

HCID 77160187N-[2-(3-bromo-5-nitrophenyl)-1-hydroxypropan-2-yl]-2-chloroacetamide

Sources & evidence

ORD record
ord-85bf7fc62d554a9a890ffce83dc4c660
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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