N-(1-Adamantylmethyl)isonicotinamide 1-oxide hydrochloride

N-(1-adamantylmethyl)-1-oxidopyridin-1-ium-4-carboxamide;hydrochloride

CAS: 61876-38-8

Molecular Formula	`C17H23ClN2O2`
Molecular Weight	322.8 g/mol
Topological Polar Surface Area	54.6 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	3
Exact Mass	322.1448
Heavy Atoms	22
Complexity	374.0

Chemical Identifiers

CAS Number	61876-38-8
SMILES	`C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC=[N+](C=C4)[O-].Cl`
InChIKey	`ZNGPQXKSCHGWML-UHFFFAOYSA-N`

📖 Product Overview

N-(1-Adamantylmethyl)isonicotinamide 1-oxide hydrochloride (CAS: 61876-38-8) is a chemical compound with molecular formula C17H23ClN2O2 and molecular weight 322.8 g/mol. Its IUPAC systematic name is N-(1-adamantylmethyl)-1-oxidopyridin-1-ium-4-carboxamide;hydrochloride. Topological Polar Surface Area 54.6 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 3 Exact Mass 322.1448 Heavy Atoms 22 Complexity 374.0 InChI Key: ZNGPQXKSCHGWML-UHFFFAOYSA-N. SMILES: C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC=[N+](C=C4)[O-].Cl.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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