Acetate → 2,4,6-Trimethylbenzoic acid

HRID 958973Notes

Reaction equation

HRID 958973 reaction equation
[C:23]([O-:24])(=[O:25])[CH3:26].[C:28]([O-:29])(=[O:30])[CH3:31].[CH3:19][C:20](=[O:21])[OH:22].[Co+2:27].[O:12]=[C:13]1[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1.[c:1]1([CH3:11])[c:2]([CH:9]=[O:10])[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1>>[c:1]1([CH3:11])[c:2]([C:9](=[O:10])[OH:12])[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1

Participants

6

Reactant 5

HCID 175Acetate2×HCID 176Acetic AcidHCID 7967CyclohexanoneHCID 102542,4,6-TrimethylbenzaldehydeHCID 104729Cobalt(2+)

Product 1

HCID 101942,4,6-Trimethylbenzoic acid

Sources & evidence

ORD record
ord-dd68e53709ae4a0c94de943c3585b1cd
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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