Hydrochloric Acid → 1-Benzyl-hexahydro-4H-azepin-4-one

HRID 2313928Notes

Reaction equation

HRID 2313928 reaction equation
[CH2:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[N:14]([CH2:15][CH2:16][CH2:17][C:21]([O:22][CH2:26][CH3:28])=[O:29])[CH2:23][CH2:24][C:25](=[O:20])[O:27][CH2:18][CH3:19].[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[ClH:30].[K+:6].[c:31]1([CH3:32])[c:33]([CH3:34])[cH:35][cH:36][cH:37][cH:38]1>>[CH2:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[N:14]1[CH2:15][CH2:16][CH2:17][C:25](=[O:27])[CH2:24][CH2:23]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 813Potassium CationHCID 7237O-XyleneHCID 45749132-Methylpropan-2-olateHCID 13664125HCID 13664125, compound

Product 1

HCID 15143501-Benzyl-hexahydro-4H-azepin-4-one

Sources & evidence

ORD record
ord-34772f07de0a447cbca82acf4682e072
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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