Benzene → HCID 178464904, compound

HRID 1229805Notes

Reaction equation

HRID 1229805 reaction equation
[CH3:1][O-:2].[CH3:20][CH:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[NH2:28].[F:4][c:5]1[cH:6][cH:7][c:8]2[c:9]([c:10](=[O:18])[cH:11][c:12]([C:14]([O:16][CH3:15])=[O:17])[o:13]2)[cH:19]1.[Na+:3].[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[F:4][c:5]1[cH:6][cH:7][c:8]2[c:9]([c:10](=[O:18])[cH:11][c:12]([C:14](=[O:16])[NH:28][CH:21]([CH3:20])[c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[o:13]2)[cH:19]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 923Sodium ionHCID 74081-PhenethylamineHCID 3826051MethoxideHCID 14089205Methyl 6-fluoro-4-oxo-4H-1-benzopyran-2-carboxylate

Product 1

HCID 178464904HCID 178464904, compound

Sources & evidence

ORD record
ord-1bdcc1d8c64040658a21f9ec20f8da3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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