Acetic Acid → 1,3-Butanedione, 1-(2-furanyl)-

HRID 138068

Reaction equation

HRID 138068 reaction equation
[CH3:10][C:11]([CH3:12])=[O:13].[CH3:14][C:15]([CH3:16])([O-:17])[CH3:18].[CH3:20][C:21](=[O:22])[OH:23].[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[K+:19].[OH2:31].[o:1]1[c:2]([C:6]([O:8][CH3:7])=[O:9])[cH:3][cH:4][cH:5]1>>[o:1]1[c:2]([C:6](=[O:8])[CH2:10][C:11]([CH3:12])=[O:13])[cH:3][cH:4][cH:5]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 180AcetoneHCID 813Potassium CationHCID 962WaterHCID 1140TolueneHCID 11902Methyl 2-furoateHCID 45749132-Methylpropan-2-olate

Product 1

HCID 121681,3-Butanedione, 1-(2-furanyl)-

Sources & evidence

ORD record
ord-a6f75f8154984e5c92e77ffb82540b68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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