Potassium Cation → 1-Isopropyl-5-methoxy-2-(toluene-4-sulfonyl)-4-trifluoromethyl-benzene

HRID 690112Notes

Reaction equation

HRID 690112 reaction equation
[Cu:36][I:37].[F-:23].[F:25][C:26]([F:27])([F:28])[I:29].[I:1][c:2]1[c:3]([O:21][CH3:22])[cH:4][c:5]([CH:18]([CH3:19])[CH3:20])[c:6]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[cH:7]1.[K+:24].[O:31]=[CH:32][N:33]([CH3:34])[CH3:35].[OH2:30]>>[c:2]1([C:26]([F:25])([F:27])[F:28])[c:3]([O:21][CH3:22])[cH:4][c:5]([CH:18]([CH3:19])[CH3:20])[c:6]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[cH:7]1

Participants

8

Reactant 7

HCID 813Potassium CationHCID 962WaterHCID 6228DimethylformamideHCID 16843TrifluoroiodomethaneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 28179Fluoride IonHCID 670534521-Iodo-4-isopropyl-2-methoxy-5-(toluene-4-sulfonyl)-benzene

Product 1

HCID 670534811-Isopropyl-5-methoxy-2-(toluene-4-sulfonyl)-4-trifluoromethyl-benzene

Sources & evidence

ORD record
ord-2cafb827ac6548ccbe795ff6075f7cfe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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