(3-Cyanopropyl)(2-hydroxyethyl)dimethylammonium bromide acetate

2-acetyloxyethyl-(3-cyanopropyl)-dimethylazanium bromide

CAS: 94946-40-4

Molecular Formula	`C10H19BrN2O2`
Molecular Weight	279.17 g/mol
Topological Polar Surface Area	50.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	278.063
Heavy Atoms	15
Complexity	228.0

Chemical Identifiers

CAS Number	94946-40-4
SMILES	`CC(=O)OCC[N+](C)(C)CCCC#N.[Br-]`
InChIKey	`KNGLVMKTPMMWOL-UHFFFAOYSA-M`

📖 Product Overview

(3-Cyanopropyl)(2-hydroxyethyl)dimethylammonium bromide acetate (CAS: 94946-40-4) is a chemical compound with molecular formula C10H19BrN2O2 and molecular weight 279.17 g/mol. Its IUPAC systematic name is 2-acetyloxyethyl-(3-cyanopropyl)-dimethylazanium bromide. Topological Polar Surface Area 50.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 278.063 Heavy Atoms 15 Complexity 228.0 InChI Key: KNGLVMKTPMMWOL-UHFFFAOYSA-M. SMILES: CC(=O)OCC[N+](C)(C)CCCC#N.[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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