Acetic Acid → HCID 86631108, compound

HRID 140489Notes

Reaction equation

HRID 140489 reaction equation
[CH3:34][C:35](=[O:36])[OH:37].[N:17]([O-:18])=[O:19].[NH2:1][c:2]1[cH:3][c:4](=[O:16])[nH:5][c:6](=[S:15])[n:7]1[CH2:8][c:9]1[n:10][cH:11][cH:12][cH:13][cH:14]1.[Na+:20].[Na+:27].[Na+:28].[S:21]([S:22]([O-:23])=[O:24])([O-:25])=[O:26].[S:29](=[O:30])(=[O:31])([OH:32])[OH:33]>>[NH2:1][c:2]1[c:3]([NH2:17])[c:4](=[O:16])[nH:5][c:6](=[S:15])[n:7]1[CH2:8][c:9]1[n:10][cH:11][cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ion3×HCID 946NitriteHCID 1086DithioniteHCID 1118Sulfuric AcidHCID 4870887HCID 4870887, compound

Product 1

HCID 86631108HCID 86631108, compound

Sources & evidence

ORD record
ord-82cb3d2cc9dc4141a962ff9b920e15d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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