Acetic Acid → 2-Methoxy-4-trifluoromethanesulfonyloxybenzoic acid

HRID 1116732Notes

Reaction equation

HRID 1116732 reaction equation
[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[O:7][CH3:8])[cH:9][cH:10][c:11]([O:13][S:14](=[O:15])(=[O:16])[C:17]([F:18])([F:19])[F:20])[cH:12]1.[CH3:26][C:27](=[O:28])[OH:29].[OH2:30].[S:21](=[O:22])(=[O:23])([OH:24])[OH:25]>>[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[OH:7])[cH:9][cH:10][c:11]([O:13][S:14](=[O:15])(=[O:16])[C:17]([F:18])([F:19])[F:20])[cH:12]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 1118Sulfuric AcidHCID 23282575Methyl 2-methoxy-4-trifluoromethane-sulfonyloxybenzoate

Product 1

HCID 231343522-Methoxy-4-trifluoromethanesulfonyloxybenzoic acid

Sources & evidence

ORD record
ord-ffb1784779584755aab9f6d2df6fe13d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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