Bicarbonate Ion → 1,2,4-Trifluoro-5-(methylsulfonyl)benzene

HRID 1125989Notes

Reaction equation

HRID 1125989 reaction equation
[Br:25][CH2:26][C:27]([OH:28])=[O:29].[C:20](=[O:21])([OH:22])[O-:23].[F:1][c:2]1[c:3]([S:10](=[O:11])(=[O:12])[Cl:13])[cH:4][c:5]([F:9])[c:6]([F:8])[cH:7]1.[Na+:18].[Na+:19].[Na+:24].[OH2:30].[S:14]([O-:15])([O-:16])=[O:17]>>[F:1][c:2]1[c:3]([S:10](=[O:11])(=[O:12])[CH3:20])[cH:4][c:5]([F:9])[c:6]([F:8])[cH:7]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion3×HCID 962WaterHCID 1099SulfiteHCID 6227Bromoacetic AcidHCID 27769792,4,5-Trifluorobenzenesulfonyl chloride

Product 1

HCID 467393961,2,4-Trifluoro-5-(methylsulfonyl)benzene

Sources & evidence

ORD record
ord-f3614416b94d495f9da154027075db6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…