Bicarbonate Ion → Ethyl 7-oxoazepane-4-carboxylate

HRID 2311965Notes

Reaction equation

HRID 2311965 reaction equation
[C:22](=[O:23])([OH:24])[O-:25].[CH3:17][S:18](=[O:19])(=[O:20])[OH:21].[Cl:27][CH:28]([Cl:29])[Cl:30].[N-:14]=[N+:15]=[N-:16].[Na+:13].[Na+:26].[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([C:8](=[O:9])[O:10][CH2:11][CH3:12])[CH2:6][CH2:7]1>>[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([C:8](=[O:9])[O:10][CH2:11][CH3:12])[CH2:6][CH2:7][NH:14]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 6212ChloroformHCID 6395Methanesulfonic AcidHCID 33558AzideHCID 317638Ethyl 4-oxocyclohexanecarboxylate

Product 1

HCID 23093698Ethyl 7-oxoazepane-4-carboxylate

Sources & evidence

ORD record
ord-51059c5de05440e4bf9a7e722d667706
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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