Isopropanol → Isopropyl Hydrogen Phenylmalonate

HRID 214319Notes

Reaction equation

HRID 214319 reaction equation
[CH3:22][N:23]([CH3:24])[CH:25]=[O:26].[CH:18]([CH3:19])([CH3:20])[OH:21].[S:14]([Cl:15])([Cl:16])=[O:17].[c:1]1([CH:7]([C:8](=[O:9])[OH:10])[C:11](=[O:12])[OH:13])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([C:8](=[O:9])[O:10][CH:18]([CH3:19])[CH3:20])[C:11](=[O:12])[OH:13])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 3776IsopropanolHCID 6228DimethylformamideHCID 24386Thionyl ChlorideHCID 75791Phenylmalonic acid

Product 1

HCID 19042994Isopropyl Hydrogen Phenylmalonate

Sources & evidence

ORD record
ord-b43c986750bd4a4ebd422e947b071791
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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