OXYPHENONIUM BROMIDE structure

OXYPHENONIUM BROMIDE

2-(2-cyclohexyl-2-hydroxy-2-phenylacetyl)oxyethyl-diethyl-methylazanium bromide

CAS: 50-10-2
Molecular Formula C21H34BrNO3
Molecular Weight 428.4 g/mol
Topological Polar Surface Area 46.5 A2
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 9
Exact Mass 427.1722
Heavy Atoms 26
Complexity 409.0

Chemical Identifiers

CAS Number 50-10-2
SMILES CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.[Br-]
InChIKey UKLQXHUGTKWPSR-UHFFFAOYSA-M

📖 Product Overview

OXYPHENONIUM BROMIDE (CAS: 50-10-2) is a chemical compound with molecular formula C21H34BrNO3 and molecular weight 428.4 g/mol. Its IUPAC systematic name is 2-(2-cyclohexyl-2-hydroxy-2-phenylacetyl)oxyethyl-diethyl-methylazanium bromide. Topological Polar Surface Area 46.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 427.1722 Heavy Atoms 26 Complexity 409.0 InChI Key: UKLQXHUGTKWPSR-UHFFFAOYSA-M. SMILES: CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)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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What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
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