Potassium Cation → 1-(4-Chloro-2-fluorophenyl)pyrrolidin-2-one

HRID 2143911Notes

Reaction equation

HRID 2143911 reaction equation
[CH2:32]1[O:33][CH2:34][CH2:35][O:36][CH2:37]1.[CH:16]1([NH2:17])[CH2:18][CH2:19][CH2:20][CH2:21][CH:22]1[NH2:23].[Cl:1][c:2]1[cH:3][c:4]([F:9])[c:5]([I:8])[cH:6][cH:7]1.[Cu:38][I:39].[K+:29].[K+:30].[K+:31].[O:10]=[C:11]1[CH2:12][CH2:13][CH2:14][NH:15]1.[P:24]([O-:25])([O-:26])([O-:27])=[O:28]>>[Cl:1][c:2]1[cH:3][c:4]([F:9])[c:5]([N:15]2[C:11](=[O:10])[CH2:12][CH2:13][CH2:14]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 46101,2-DiaminocyclohexaneHCID 120252-PyrrolidoneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 27365624-Chloro-2-fluoro-1-iodobenzene

Product 1

HCID 576910901-(4-Chloro-2-fluorophenyl)pyrrolidin-2-one

Sources & evidence

ORD record
ord-367bc428570b47959f3968eeb4763dfb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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