O-Xylene → 3-(2,4-Dimethoxyphenyl)octanoic acid

HRID 700649Notes

Reaction equation

HRID 700649 reaction equation
[CH3:1][O:2][c:3]1[c:4]([CH:11]([CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[CH:17]([C:18](=[O:19])[OH:20])[C:21]([OH:22])=[O:23])[cH:5][cH:6][c:7]([O:9][CH3:10])[cH:8]1.[c:24]1([CH3:25])[c:26]([CH3:27])[cH:28][cH:29][cH:30][cH:31]1>>[CH3:1][O:2][c:3]1[c:4]([CH:11]([CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[CH2:17][C:18](=[O:19])[OH:20])[cH:5][cH:6][c:7]([O:9][CH3:10])[cH:8]1

Participants

3

Reactant 2

HCID 7237O-XyleneHCID 193484652-[1-(2,4-Dimethoxyphenyl)hexyl]malonic acid

Product 1

HCID 193486193-(2,4-Dimethoxyphenyl)octanoic acid

Sources & evidence

ORD record
ord-c84a282a65dd43968f8f563bf044db69
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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