Acetic Acid → Acetaldehyde, 2-[4-(1,1-dimethylethyl)phenoxy]-

HRID 86565

Reaction equation

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

Participants

Reactant 4

HCID 176Acetic Acid

HCID 313Hydrochloric Acid

HCID 962Water

HCID 3085718Benzene, 1-(2,2-dimethoxyethoxy)-4-(1,1-dimethylethyl)-

Product 1

HCID 166373Acetaldehyde, 2-[4-(1,1-dimethylethyl)phenoxy]-

Sources & evidence

ORD record: ord-de85829d449445eea04f168d55022567
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

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