Acetic Acid → 5-aminoisoquinolin-1(2H)-one

HRID 316516Notes

Reaction equation

HRID 316516 reaction equation
[C:15]([OH:16])(=[O:17])[CH3:18].[CH3:19][CH2:20][OH:21].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]2[cH:6][cH:7][nH:8][c:9](=[O:14])[c:10]2[cH:11][cH:12][cH:13]1>>[NH2:1][c:4]1[c:5]2[cH:6][cH:7][nH:8][c:9](=[O:14])[c:10]2[cH:11][cH:12][cH:13]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 702EthanolHCID 2313785-Nitro-1,2-dihydroisoquinolin-1-one

Product 1

HCID 20725-aminoisoquinolin-1(2H)-one

Sources & evidence

ORD record
ord-7285cad569df4c4097ee71d164f19c22
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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