Potassium Cation → 1-Methyl-3-(2-methyl-4-nitrophenyl)tetrahydropyrimidin-2(1H)-one

HRID 168728Notes

Reaction equation

HRID 168728 reaction equation
[CH3:20][N:21]1[C:22](=[O:27])[NH:23][CH2:24][CH2:25][CH2:26]1.[Cu:38][I:39].[I:9][c:10]1[c:11]([CH3:19])[cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]1.[K+:6].[K+:7].[K+:8].[NH2:28][CH2:29][CH2:30][NH2:31].[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[P:1]([O-:2])([O-:3])([O-:4])=[O:5]>>[c:10]1([N:23]2[C:22](=[O:27])[N:21]([CH3:20])[CH2:26][CH2:25][CH2:24]2)[c:11]([CH3:19])[cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 3301EthylenediamineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 792252-Iodo-5-nitrotolueneHCID 128677481-Methyltetrahydropyrimidin-2(1H)-one

Product 1

HCID 595867031-Methyl-3-(2-methyl-4-nitrophenyl)tetrahydropyrimidin-2(1H)-one

Sources & evidence

ORD record
ord-2f84ae50605b461d9b0d62eb8a5a6f53
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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