Ethanol → 3-Amino-1,2,4-benzotriazine

HRID 2316132Notes

Reaction equation

[CH3:21][CH2:22][OH:23].[Na+:19].[Na+:20].[S:13]([S:14]([O-:15])=[O:16])([O-:17])=[O:18].[n+:1]1([O-:12])[n:2][c:3]([NH2:11])[n:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2>>[n:1]1[n:2][c:3]([NH2:11])[n:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2

Participants

Reactant 4

HCID 702Ethanol

HCID 923Sodium ion2×

HCID 1086Dithionite

HCID 794703-Amino-1,2,4-benzotriazine-1-oxide

Product 1

HCID 883363-Amino-1,2,4-benzotriazine

Sources & evidence

ORD record: ord-11af567b05ae40dc9207d8ae03704eff
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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