Acetate → HCID 178468339, compound

HRID 187363Notes

Reaction equation

HRID 187363 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH3:23][C:24]([CH2:25][C:26]([CH3:27])=[O:28])=[O:29].[CH3:31][C:32](=[O:33])[O-:34].[CH3:41][CH2:42][OH:43].[K+:30].[N:19]([O-:20])=[O:21].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[Na+:22].[Na+:39].[Na+:40].[OH:15][N+:16](=[O:17])[O-:18].[P:10](=[O:11])([OH:12])([OH:13])[OH:14]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1)[N:19]=[C:25]([C:24]([CH3:23])=[O:29])[C:26]([CH3:27])=[O:28]

Participants

11

Reactant 10

HCID 175AcetateHCID 702EthanolHCID 813Potassium CationHCID 923Sodium ion3×HCID 944Nitric AcidHCID 946NitriteHCID 1004Phosphoric AcidHCID 133964-AminobenzonitrileHCID 19660Carbonate IonHCID 31261Acetylacetone

Product 1

HCID 178468339HCID 178468339, compound

Sources & evidence

ORD record
ord-23d6cee64fe743438d37bb7a6716b529
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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