Sodium ion → Benzoic acid, 5-sulfino-2-(trifluoromethoxy)-

HRID 1208238Notes

Reaction equation

HRID 1208238 reaction equation
[Cl:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][C:15]([F:16])([F:17])[F:18])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1.[Na+:23].[Na+:24].[Na+:26].[OH-:25].[OH2:32].[S:19]([O-:20])([O-:21])=[O:22].[S:27](=[O:28])(=[O:29])([OH:30])[OH:31]>>[S:2](=[O:3])([OH:4])[c:5]1[cH:6][cH:7][c:8]([O:14][C:15]([F:16])([F:17])[F:18])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1

Participants

7

Reactant 6

HCID 923Sodium ion3×HCID 961HydroxideHCID 962WaterHCID 1099SulfiteHCID 1118Sulfuric AcidHCID 86600705845616-29-7

Product 1

HCID 69037717Benzoic acid, 5-sulfino-2-(trifluoromethoxy)-

Sources & evidence

ORD record
ord-26ecc017dabc4243827e96cddcb1ffc7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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