Sodium ion → (2,2,2-Trifluoro-1-methylethyl) 2-naphthalenesulfonate

HRID 157201

Reaction equation

HRID 157201 reaction equation
[CH3:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[F:22][C:23]([CH:24]([CH3:25])[OH:26])([F:27])[F:28].[H-:29].[Na+:30].[OH2:31].[cH:1]1[c:2]([S:11](=[O:12])(=[O:13])[Cl:14])[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[cH:1]1[c:2]([S:11](=[O:12])(=[O:13])[O:26][CH:24]([C:23]([F:22])([F:27])[F:28])[CH3:25])[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 71252-Naphthalenesulfonyl chlorideHCID 97741,1,1-Trifluoro-2-propanolHCID 166653Hydride

Product 1

HCID 53934608(2,2,2-Trifluoro-1-methylethyl) 2-naphthalenesulfonate

Sources & evidence

ORD record
ord-e2d927c75ff743c0b6630d9d261198e8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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