Acetone → 3-Chloro-6-(1-cyanoethoxy)-benzaldehyde

HRID 1206571

Reaction equation

HRID 1206571 reaction equation
[C:11](=[O:12])([O-:13])[O-:14].[CH3:22][C:23](=[O:24])[CH3:25].[Cl:17][CH:18]([C:19]#[N:20])[CH3:21].[Cl:1][c:2]1[cH:3][cH:4][c:5]([OH:10])[c:6]([CH:7]=[O:8])[cH:9]1.[K+:15].[K+:16]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:10][CH:18]([C:19]#[N:20])[CH3:21])[c:6]([CH:7]=[O:8])[cH:9]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 124815-Chloro-salicylaldehydeHCID 19660Carbonate IonHCID 5192252-Chloropropionitrile

Product 1

HCID 215539233-Chloro-6-(1-cyanoethoxy)-benzaldehyde

Sources & evidence

ORD record
ord-68a6890e64f44fcc8a2d685d75b8da8d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Linked notes

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