Acetone → 4-(2-Chloro-5-fluorophenyl)-3-buten-2-one

HRID 199323Notes

Reaction equation

HRID 199323 reaction equation
[CH3:13][C:14]([CH3:15])=[O:16].[Cl:3][c:4]1[c:5]([CH:6]=[O:7])[cH:8][c:9]([F:12])[cH:10][cH:11]1.[Na+:2].[OH-:1].[OH2:17]>>[Cl:3][c:4]1[c:5]([CH:6]=[CH:13][C:14]([CH3:15])=[O:16])[cH:8][c:9]([F:12])[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 27791842-Chloro-5-Fluorobenzaldehyde

Product 1

HCID 539229184-(2-Chloro-5-fluorophenyl)-3-buten-2-one

Sources & evidence

ORD record
ord-4fc41b0ca31b4de791cb87f164ab47b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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