Carbanilic acid, o-(hexyloxy)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride

2-(azepan-1-ium-1-yl)ethyl N-(2-hexoxyphenyl)carbamate chloride

CAS: 60558-14-7

Molecular Formula	`C21H35ClN2O3`
Molecular Weight	399.0 g/mol
Topological Polar Surface Area	52.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	11
Exact Mass	398.2336
Heavy Atoms	27
Complexity	370.0

Chemical Identifiers

CAS Number	60558-14-7
SMILES	`CCCCCCOC1=CC=CC=C1NC(=O)OCC[NH+]2CCCCCC2.[Cl-]`
InChIKey	`KVGZBJCHPHMRDY-UHFFFAOYSA-N`

📖 Product Overview

Carbanilic acid, o-(hexyloxy)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride (CAS: 60558-14-7) is a chemical compound with molecular formula C21H35ClN2O3 and molecular weight 399.0 g/mol. Its IUPAC systematic name is 2-(azepan-1-ium-1-yl)ethyl N-(2-hexoxyphenyl)carbamate chloride. Topological Polar Surface Area 52.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 11 Exact Mass 398.2336 Heavy Atoms 27 Complexity 370.0 InChI Key: KVGZBJCHPHMRDY-UHFFFAOYSA-N. SMILES: CCCCCCOC1=CC=CC=C1NC(=O)OCC[NH+]2CCCCCC2.[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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