Acetaldehyde → 2-(1-hydroxyethyl)-3-hydroxy-pyran-4(1H)-one

HRID 212853

Reaction equation

HRID 212853 reaction equation
[CH:11]([CH3:12])=[O:13].[ClH:14].[Na+:10].[OH-:9].[OH2:15].[OH:1][c:2]1[cH:3][o:4][cH:5][cH:6][c:7]1=[O:8]>>[OH:1][c:2]1[c:3]([CH:11]([CH3:12])[OH:13])[o:4][cH:5][cH:6][c:7]1=[O:8]

Participants

7

Reactant 6

HCID 177AcetaldehydeHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 681293-Hydroxy-4H-pyran-4-one

Product 1

HCID 186788052-(1-hydroxyethyl)-3-hydroxy-pyran-4(1H)-one

Sources & evidence

ORD record
ord-853d91ed3ce1497493f3083d11aafc90
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

Loading…