Diethyl(2-hydroxyethyl)methylammonium bromide alpha-(1-hydroxypropyl)cyclohexaneacetate

2-(2-cyclohexyl-3-hydroxypentanoyl)oxyethyl-diethyl-methylazanium bromide

CAS: 98843-98-2

Molecular Formula	`C18H36BrNO3`
Molecular Weight	394.4 g/mol
Topological Polar Surface Area	46.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	10
Exact Mass	393.18787
Heavy Atoms	23
Complexity	322.0

Chemical Identifiers

CAS Number	98843-98-2
SMILES	`CCC(C(C1CCCCC1)C(=O)OCC[N+](C)(CC)CC)O.[Br-]`
InChIKey	`CNQIVBVGPHOISR-UHFFFAOYSA-M`

📖 Product Overview

Diethyl(2-hydroxyethyl)methylammonium bromide alpha-(1-hydroxypropyl)cyclohexaneacetate (CAS: 98843-98-2) is a chemical compound with molecular formula C18H36BrNO3 and molecular weight 394.4 g/mol. Its IUPAC systematic name is 2-(2-cyclohexyl-3-hydroxypentanoyl)oxyethyl-diethyl-methylazanium bromide. Topological Polar Surface Area 46.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 393.18787 Heavy Atoms 23 Complexity 322.0 InChI Key: CNQIVBVGPHOISR-UHFFFAOYSA-M. SMILES: CCC(C(C1CCCCC1)C(=O)OCC[N+](C)(CC)CC)O.[Br-].

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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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