Potassium Cation → Methyl 2-(3,5-dimethylphenyl)sulfanylbenzoate

Reaction equation

[C:10]([c:11]1[c:12]([SH:13])[cH:14][cH:15][cH:16][cH:17]1)(=[O:18])[O:19][CH3:20].[CH3:29][O:30][CH2:31][CH2:32][O:33][CH3:34].[Cu:27][I:28].[I:1][c:2]1[cH:3][c:4]([CH3:9])[cH:5][c:6]([CH3:8])[cH:7]1.[K+:21].[K+:22].[O-:23][C:24]([O-:25])=[O:26]>>[c:2]1([S:13][c:12]2[c:11]([C:10](=[O:18])[O:19][CH3:20])[cH:17][cH:16][cH:15][cH:14]2)[cH:3][c:4]([CH3:9])[cH:5][c:6]([CH3:8])[cH:7]1

Participants

Reactant 6

HCID 813Potassium Cation2×

HCID 80711,2-Dimethoxyethane

HCID 19660Carbonate Ion

HCID 21009Benzoic acid, 2-mercapto-, methyl ester

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

HCID 1409241-Iodo-3,5-dimethylbenzene

Product 1

Sources & evidence

ORD record: ord-1faf7e9bf1034666bcb9060ee1af9b5f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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