Sodium ion → 2-(4-(Trifluoromethylthio)benzyl)-2-(3,3,3-trifluoropropyl)malononitrile

HRID 149370

Reaction equation

HRID 149370 reaction equation
[Br:20][CH2:21][CH2:22][C:23]([F:24])([F:25])[F:26].[CH3:27][N:28]([CH3:29])[CH:30]=[O:31].[F:1][C:2]([S:3][c:4]1[cH:5][cH:6][c:7]([CH2:8][CH:9]([C:10]#[N:11])[C:12]#[N:13])[cH:14][cH:15]1)([F:16])[F:17].[H-:18].[Na+:19]>>[F:1][C:2]([S:3][c:4]1[cH:5][cH:6][c:7]([CH2:8][C:9]([C:10]#[N:11])([C:12]#[N:13])[CH2:21][CH2:22][C:23]([F:24])([F:25])[F:26])[cH:14][cH:15]1)([F:16])[F:17]

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 166653HydrideHCID 27251143-Bromo-1,1,1-trifluoropropaneHCID 22234991(4-(Trifluoromethylthio)benzyl)malononitrile

Product 1

HCID 222350612-(4-(Trifluoromethylthio)benzyl)-2-(3,3,3-trifluoropropyl)malononitrile

Sources & evidence

ORD record
ord-121203cd8de74dcb9144cd10c520015e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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