Methanol → [[5-Bromo-3-(2-fluorophenyl)-1,2-benzisoxazol-6-yl]sulfinyl]acetic acid

HRID 664357Notes

Reaction equation

HRID 664357 reaction equation
[Br:1][c:2]1[c:3]([S:18][CH2:19][C:20](=[O:21])[OH:22])[cH:4][c:5]2[c:6]([c:7](-[c:10]3[c:11]([F:16])[cH:12][cH:13][cH:14][cH:15]3)[n:8][o:9]2)[cH:17]1.[CH3:35][OH:36].[I+2:29]([O-:30])([O-:31])[O-:32].[I+3:23]([O-:24])([O-:25])([O-:26])[O-:27].[Na+:28].[Na+:33].[OH2:34]>>[Br:1][c:2]1[c:3]([S:18]([CH2:19][C:20](=[O:21])[OH:22])=[O:24])[cH:4][c:5]2[c:6]([c:7](-[c:10]3[c:11]([F:16])[cH:12][cH:13][cH:14][cH:15]3)[n:8][o:9]2)[cH:17]1

Participants

7

Reactant 6

HCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 84927IodateHCID 167232PeriodateHCID 54144274[[5-Bromo-3-(2-fluorophenyl)-1,2-benzisoxazol-6-yl]thio]acetic acid

Product 1

HCID 13656093[[5-Bromo-3-(2-fluorophenyl)-1,2-benzisoxazol-6-yl]sulfinyl]acetic acid

Sources & evidence

ORD record
ord-2a709ace04704fa78011ccf514fa6c7b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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