Acetate → 2,4,6-Trimethylphenol

HRID 676454Notes

Reaction equation

HRID 676454 reaction equation
[CH3:11][c:12]1[cH:13][c:14]([CH3:15])[cH:16][c:17]([CH3:18])[c:19]1[CH2:20][c:21]1[cH:22][c:23]([CH3:24])[cH:25][c:26]([CH3:27])[cH:28]1.[CH3:29][C:30]([OH:31])=[O:32].[O-:34][C:35]([CH3:36])=[O:37].[O-:38][C:39]([CH3:40])=[O:41].[O:10].[Pd+2:33].[c:1]1([CH3:9])[cH:2][c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1>>[c:1]1([CH3:9])[c:2]([OH:31])[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 176Acetic AcidHCID 962WaterHCID 7947MesityleneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 10125229Stk331795

Product 1

HCID 106982,4,6-Trimethylphenol

Sources & evidence

ORD record
ord-0fb2abf0614642abb297c9841b9b6e10
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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