Methanol → p-Toluenesulfonate

HRID 1217869Notes

Reaction equation

HRID 1217869 reaction equation
[CH3:1][c:2]1[cH:3][c:4]([O:5][CH2:6][C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[cH:14][cH:15][c:16]1[N+:17]([O-:18])=[O:19].[CH3:34][OH:35].[H:32][H:33].[OH2:20].[c:21]1([CH3:31])[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[OH:30])[cH:25][cH:26]1>>[CH3:1][c:2]1[cH:3][c:4]([O:5][CH2:6][C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[cH:14][cH:15][c:16]1[NH2:17].[c:21]1([CH3:31])[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[O-:30])[cH:25][cH:26]1

Participants

7

Reactant 5

HCID 887MethanolHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 23370041t-Butyl 3-methyl-4-nitrophenoxyacetateHCID 178418361HCID 178418361, compound

Product 2

HCID 85570p-ToluenesulfonateHCID 23370016Tert-butyl 2-(4-amino-3-methylphenoxy)acetate

Sources & evidence

ORD record
ord-a0406de6135448c1a61007fdc32aeb58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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