Carbonate Ion → 4-(3-Ethyl-3-hydroxy-2-propan-2-ylpyrrolidin-1-yl)-2-fluorobenzonitrile

HRID 1123807Notes

Reaction equation

HRID 1123807 reaction equation
[CH2:1]([CH3:2])[C:3]1([OH:11])[CH:4]([CH:8]([CH3:9])[CH3:10])[NH:5][CH2:6][CH2:7]1.[F:12][c:13]1[c:14]([C:15]#[N:16])[cH:17][cH:18][c:19]([F:21])[cH:20]1.[Li+:22].[Li+:23].[O-:24][C:25](=[O:26])[O-:27]>>[CH2:1]([CH3:2])[C:3]1([OH:11])[CH:4]([CH:8]([CH3:9])[CH3:10])[N:5]([c:19]2[cH:18][cH:17][c:14]([C:15]#[N:16])[c:13]([F:12])[cH:20]2)[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 28486Lithium ion2×HCID 775452,4-DifluorobenzonitrileHCID 178438148HCID 178438148, compound

Product 1

HCID 722672634-(3-Ethyl-3-hydroxy-2-propan-2-ylpyrrolidin-1-yl)-2-fluorobenzonitrile

Sources & evidence

ORD record
ord-6d847f3e1c80417bbbb9a20dd959fa47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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