Bicarbonate Ion → HCID 20392596, compound

HRID 2127527Notes

Reaction equation

HRID 2127527 reaction equation
[CH3:34][N:35]([CH3:36])[C:37](=[O:38])[CH3:39].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[K+:23].[K+:24].[Na+:33].[O-:25][C:26]([O-:27])=[O:28].[O-:29][C:30]([OH:31])=[O:32].[OH:10][c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:15][cH:16]1>>[c:2]1([O:10][c:11]2[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:15][cH:16]2)[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 813Potassium Cation2×HCID 923Sodium ionHCID 145174-FluorobenzonitrileHCID 19660Carbonate IonHCID 28310Ethyl 4-hydroxyphenylacetateHCID 31374Dimethylacetamide

Product 1

HCID 20392596HCID 20392596, compound

Sources & evidence

ORD record
ord-718455b5dec445d79e16b2815147f94f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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