Potassium Cation → Methyl 3-chloro-2-methylbenzoate

Reaction equation

[C:14](=[O:15])([O-:16])[O-:17].[CH3:20][N:21]([CH3:22])[CH:23]=[O:24].[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[Cl:3][c:4]1[c:5]([CH3:13])[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12]1.[I:1][CH3:2].[K+:18].[K+:19].[OH2:31]>>[Cl:3][c:4]1[c:5]([CH3:13])[c:6]([C:7](=[O:8])[O:9][CH3:14])[cH:10][cH:11][cH:12]1

Participants

Reactant 7

HCID 813Potassium Cation2×

HCID 962Water

HCID 6228Dimethylformamide

HCID 6328Methyl iodide

HCID 8857Ethyl Acetate

HCID 19660Carbonate Ion

HCID 820103-Chloro-2-methylbenzoic acid

Product 1

HCID 5077673Methyl 3-chloro-2-methylbenzoate

Sources & evidence

ORD record: ord-029779fac1da44d69783fc25fda62f27
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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