Sodium ion → 4-[4-(Benzenesulfonyl)phenyl]-1,1,1-trifluoro-2-methylbut-3-en-2-ol

HRID 155080Notes

Reaction equation

HRID 155080 reaction equation
[Al+3:26].[H-:25].[H-:28].[H-:29].[H-:30].[Li+:27].[Na+:33].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH-:32].[OH2:31].[c:1]1([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][cH:12][c:13]([C:16]#[C:17][C:18]([C:19]([F:20])([F:21])[F:22])([CH3:23])[OH:24])[cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][cH:12][c:13]([CH:16]=[CH:17][C:18]([C:19]([F:20])([F:21])[F:22])([CH3:23])[OH:24])[cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 199393031-(4-Phenylsulfonylphenyl)-3-hydroxy-3-methyl-4,4,4-trifluorobut-1-yne

Product 1

HCID 540240444-[4-(Benzenesulfonyl)phenyl]-1,1,1-trifluoro-2-methylbut-3-en-2-ol

Sources & evidence

ORD record
ord-b49a31fc81744f2885f292259c673b45
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…