Carbonate Ion → 4-(3-Hydroxy-2,3-dimethylpyrrolidin-1-yl)-3-(trifluoromethyl)benzonitrile

HRID 168175

Reaction equation

HRID 168175 reaction equation
[CH3:1][CH:2]1[NH:3][CH2:4][CH2:5][C:6]1([OH:7])[CH3:8].[F:9][c:10]1[c:11]([C:18]([F:19])([F:20])[F:21])[cH:12][c:13]([C:14]#[N:15])[cH:16][cH:17]1.[Li+:22].[Li+:23].[O-:24][C:25](=[O:26])[O-:27]>>[CH3:1][CH:2]1[N:3]([c:10]2[c:11]([C:18]([F:19])([F:20])[F:21])[cH:12][c:13]([C:14]#[N:15])[cH:16][cH:17]2)[CH2:4][CH2:5][C:6]1([OH:7])[CH3:8]

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 28486Lithium ion2×HCID 1442554-Fluoro-3-(trifluoromethyl)benzonitrileHCID 723256612,3-Dimethylpyrrolidin-3-ol

Product 1

HCID 772772864-(3-Hydroxy-2,3-dimethylpyrrolidin-1-yl)-3-(trifluoromethyl)benzonitrile

Sources & evidence

ORD record
ord-7c1a1ddb623341a5b22bce0446dd8e2d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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