Acetone → 4-(2,3-Dihydro-2,2,4,5,6-pentamethylbenzofuran-7-yl)-3-buten-2-one

HRID 137593Notes

Reaction equation

HRID 137593 reaction equation
[CH3:1][C:2]1([CH3:16])[O:3][c:4]2[c:5]([c:7]([CH3:15])[c:8]([CH3:14])[c:9]([CH3:13])[c:10]2[CH:11]=[O:12])[CH2:6]1.[CH3:20][C:21]([CH3:22])=[O:23].[Na+:19].[OH-:18].[OH2:17]>>[CH3:1][C:2]1([CH3:16])[O:3][c:4]2[c:5]([c:7]([CH3:15])[c:8]([CH3:14])[c:9]([CH3:13])[c:10]2[CH:11]=[CH:20][C:21]([CH3:22])=[O:23])[CH2:6]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 190470682,3-Dihydro-2,2,4,5,6-pentamethylbenzofuran-7-carboxaldehyde

Product 1

HCID 540298864-(2,3-Dihydro-2,2,4,5,6-pentamethylbenzofuran-7-yl)-3-buten-2-one

Sources & evidence

ORD record
ord-68ab853250404403af4577c5134348b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…