Chloride → 2-Nitro-4-phenoxybenzoic acid

HRID 2148427Notes

Reaction equation

HRID 2148427 reaction equation
[Cl-:32].[Cl:16][C:17]([C:18]([Cl:19])=[O:20])=[O:21].[Cl:33][CH2:34][Cl:35].[H-:29].[H-:31].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10][c:11]([N+:13]([O-:14])=[O:15])[cH:12]1.[Na+:30].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40].[OH:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10][c:11]([O:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:12]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 923Sodium ionHCID 996PhenolHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 118802,4-Dinitrobenzoic acidHCID 65578Oxalyl chlorideHCID 166653Hydride2×

Product 1

HCID 179893262-Nitro-4-phenoxybenzoic acid

Sources & evidence

ORD record
ord-bf84db787ea5408c9bc04f9c10614854
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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