Water → 4-Acetoxy-3-fluorobenzoic acid

HRID 144772

Reaction equation

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

Participants

Reactant 4

HCID 962Water

HCID 1118Sulfuric Acid

HCID 7918Acetic Anhydride

HCID 1604563-Fluoro-4-hydroxybenzoic acid

Product 1

HCID 193653054-Acetoxy-3-fluorobenzoic acid

Sources & evidence

ORD record: ord-a6d5d5f254f94320917ef7a4a705ab77
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Linked notes

Loading…