Sodium ion → 3-[4-Chloro-3-(2-diethoxyphosphorylethenyl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

HRID 179589Notes

Reaction equation

HRID 179589 reaction equation
[CH2:1]([P:2]([O:3][CH2:4][CH3:5])(=[O:6])[O:7][CH2:8][CH3:9])[P:10]([O:11][CH2:12][CH3:13])(=[O:14])[O:15][CH2:16][CH3:17].[Cl:20][c:21]1[c:22]([CH:23]=[O:24])[cH:25][c:26](-[n:29]2[c:30](=[O:41])[n:31]([CH3:40])[c:32]([C:36]([F:37])([F:38])[F:39])[cH:33][c:34]2=[O:35])[cH:27][cH:28]1.[H-:18].[Na+:19]>>[CH:1]([P:10]([O:11][CH2:12][CH3:13])(=[O:14])[O:15][CH2:16][CH3:17])=[CH:23][c:22]1[c:21]([Cl:20])[cH:28][cH:27][c:26](-[n:29]2[c:30](=[O:41])[n:31]([CH3:40])[c:32]([C:36]([F:37])([F:38])[F:39])[cH:33][c:34]2=[O:35])[cH:25]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 15455Tetraethyl methylenediphosphonateHCID 166653HydrideHCID 212012252-Chloro-5-[3,6-dihydro-2,6-dioxo-3-methyl-4-trifluoromethyl-1(2H)-pyrimidinyl]benzaldehyde

Product 1

HCID 572384743-[4-Chloro-3-(2-diethoxyphosphorylethenyl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Sources & evidence

ORD record
ord-37f9ec7c56fa45b5b920850c523c7dfc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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