Acetic Acid → 3-Amino-6-chloropyridine-2-carbonitrile

HRID 1543054Notes

Reaction equation

HRID 1543054 reaction equation
[CH3:13][C:14](=[O:15])[OH:16].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N+:10]([O-:11])=[O:12])[c:6]([C:8]#[N:9])[n:7]1.[Na+:23].[Na+:24].[O:25]=[P:26]12[O:27][P:28]3(=[O:38])[O:29][P:30](=[O:36])([O:31][P:32](=[O:35])([O:33]3)[O:34]1)[O:37]2.[OH2:39].[S:17]([S:18]([O-:19])=[O:20])([O-:21])=[O:22]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH2:10])[c:6]([C:8]#[N:9])[n:7]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ion2×HCID 962WaterHCID 1086DithioniteHCID 14812Phosphorus oxide (P4O10)HCID 133817056-Chloro-3-nitropyridine-2-carbonitrile

Product 1

HCID 5927503-Amino-6-chloropyridine-2-carbonitrile

Sources & evidence

ORD record
ord-44a96e945a8541d092ea92fd6f32707b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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