Ethylene Glycol → 2,5-Dimethylphenylacetic acid

HRID 667940Notes

Reaction equation

HRID 667940 reaction equation
[CH3:2][C:3]([O-:4])=[O:5].[Cl:6][CH2:7][C:8]1([c:16]2[c:17]([CH3:23])[cH:18][cH:19][c:20]([CH3:22])[cH:21]2)[O:9][CH2:10][C:11]([CH3:12])([CH3:13])[CH2:14][O:15]1.[Na+:1].[Na+:25].[OH-:24].[OH2:30].[OH:26][CH2:27][CH2:28][OH:29]>>[CH2:2]([C:3]([OH:4])=[O:5])[c:16]1[c:17]([CH3:23])[cH:18][cH:19][c:20]([CH3:22])[cH:21]1

Participants

7

Reactant 6

HCID 174Ethylene GlycolHCID 175AcetateHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 578106312-Chloromethyl-5,5-dimethyl-2-(2,5-dimethylphenyl)-[1,3]dioxane

Product 1

HCID 836152,5-Dimethylphenylacetic acid

Sources & evidence

ORD record
ord-223e62a93a8244a18f405e587cce0a35
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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