Ammonium → 6-(3-Bromo-5-fluorophenyl)-1,4,4-trimethyl-1,4-dihydrobenzo[d][1,3]oxazin-2-one

HRID 115123

Reaction equation

HRID 115123 reaction equation
[Br:1][c:2]1[cH:3][c:4](-[c:9]2[cH:10][c:11]3[c:12]([cH:20][cH:21]2)[NH:13][C:14](=[O:19])[O:15][C:16]3([CH3:17])[CH3:18])[cH:5][c:6]([F:8])[cH:7]1.[Cl-:26].[H-:22].[I:24][CH3:25].[NH4+:27].[Na+:23].[O:28]=[CH:29][N:30]([CH3:31])[CH3:32]>>[Br:1][c:2]1[cH:3][c:4](-[c:9]2[cH:10][c:11]3[c:12]([cH:20][cH:21]2)[N:13]([CH3:25])[C:14](=[O:19])[O:15][C:16]3([CH3:17])[CH3:18])[cH:5][c:6]([F:8])[cH:7]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium ionHCID 6228DimethylformamideHCID 6328Methyl iodideHCID 166653HydrideHCID 98098756-(3-Bromo-5-fluorophenyl)-4,4-dimethyl-1,4-dihydrobenzo[d][1,3]oxazin-2-one

Product 1

HCID 102701136-(3-Bromo-5-fluorophenyl)-1,4,4-trimethyl-1,4-dihydrobenzo[d][1,3]oxazin-2-one

Sources & evidence

ORD record
ord-67faf16a8a3e4b2f80c5f7b6d7be9b1f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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