Acetate → Methyl 1-(4-fluorophenyl)-5-nitro-2-oxo-1,2-dihydropyridine-3-carboxylate

HRID 681061Notes

Reaction equation

HRID 681061 reaction equation
[C:38]([O-:39])(=[O:40])[CH3:41].[C:43]([O-:44])(=[O:45])[CH3:46].[Cu+2:42].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([C:11](=[O:12])[O:13][CH3:14])[c:7](=[O:10])[nH:8][cH:9]1.[NH3:37].[O:31]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36]1.[OH:15][B:16]([OH:17])[c:18]1[cH:19][cH:20][c:21]([F:22])[cH:23][cH:24]1.[cH:25]1[cH:26][cH:27][n:28][cH:29][cH:30]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([C:11](=[O:12])[O:13][CH3:14])[c:7](=[O:10])[n:8](-[c:18]2[cH:19][cH:20][c:21]([F:22])[cH:23][cH:24]2)[cH:9]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 222AmmoniaHCID 1049PyridineHCID 27099Cupric cationHCID 312751,4-DioxaneHCID 2856454-Fluorophenylboronic acidHCID 7204882Methyl 2-hydroxy-5-nitronicotinate

Product 1

HCID 21081724Methyl 1-(4-fluorophenyl)-5-nitro-2-oxo-1,2-dihydropyridine-3-carboxylate

Sources & evidence

ORD record
ord-ee93d03054e043f4864cdfc959632136
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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