Potassium Cation → 2,3,4,5-Tetrahydro-1,4-benzoxazepin-5-one

HRID 197690

Reaction equation

HRID 197690 reaction equation
[K+:17].[N-:13]=[N+:14]=[N-:15].[Na+:12].[O:1]1[CH2:2][CH2:3][C:4](=[O:11])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21.[OH-:16].[S:18](=[O:19])(=[O:20])([OH:21])[OH:22]>>[O:1]1[CH2:2][CH2:3][NH:13][C:4](=[O:11])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21

Participants

7

Reactant 6

HCID 813Potassium CationHCID 923Sodium ionHCID 961HydroxideHCID 1118Sulfuric AcidHCID 33558AzideHCID 68110Chromanone

Product 1

HCID 3406292,3,4,5-Tetrahydro-1,4-benzoxazepin-5-one

Sources & evidence

ORD record
ord-908137b554f1442ca895547873628686
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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