Acetic Acid → HCID 20566324, compound

HRID 1121563Notes

Reaction equation

HRID 1121563 reaction equation
[C:26](=[O:27])([O-:28])[OH:29].[CH3:32][C:33](=[O:34])[OH:35].[K+:22].[N:1]([O-:2])=[O:3].[NH2:5][c:6]1[cH:7][cH:8][c:9]([S:12][CH2:13][c:14]2[n:15][o:16][cH:17][n:18]2)[cH:10][cH:11]1.[Na+:30].[Na+:4].[OH2:31].[S-:19][C:20]#[N:21].[S-:23][C:24]#[N:25].[S:36](=[O:37])(=[O:38])([OH:39])[OH:40]>>[c:6]1([S:19][C:20]#[N:21])[cH:7][cH:8][c:9]([S:12][CH2:13][c:14]2[n:15][o:16][cH:17][n:18]2)[cH:10][cH:11]1

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 813Potassium CationHCID 923Sodium ion2×HCID 946NitriteHCID 962WaterHCID 1118Sulfuric AcidHCID 9322Thiocyanate2×HCID 20566329HCID 20566329, compound

Product 1

HCID 20566324HCID 20566324, compound

Sources & evidence

ORD record
ord-2c7df74684b740b287587a17dc0c15c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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