Acetone → 3-Methyl Flunitrazepam

HRID 697674Notes

Reaction equation

HRID 697674 reaction equation
[C:24](=[O:25])([O-:26])[O-:27].[CH3:30][I:31].[CH3:32][C:33](=[O:34])[CH3:35].[F:1][c:2]1[c:3]([C:8]2=[N:9][CH:10]([CH3:23])[C:11](=[O:22])[NH:12][c:13]3[c:14]2[cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]3)[cH:4][cH:5][cH:6][cH:7]1.[K+:28].[K+:29]>>[F:1][c:2]1[c:3]([C:8]2=[N:9][CH:10]([CH3:23])[C:11](=[O:22])[N:12]([CH3:24])[c:13]3[c:14]2[cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]3)[cH:4][cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 6328Methyl iodideHCID 19660Carbonate IonHCID 20542078(+)-5-(o-fluorophenyl)-1,3-dihydro-3-methyl-7-nitro-2H-1,4-benzodiazepin-2-one

Product 1

HCID 205623323-Methyl Flunitrazepam

Sources & evidence

ORD record
ord-00d125a1643c4e0cbe85c683b79c0450
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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