8-Doxylpalmitoylcholine structure

8-Doxylpalmitoylcholine

Also Known As: 8-Doxylpalmitoylcholine|KST-1A6917|8-(4',4'-Dimethyloxazolidine-N-oxyl)palmitoylcholine|(4,4-dimethyl-2-octyl-2-{7-oxo-7-[2-(trimethylammonio)ethoxy]heptyl}-1,3-oxazolidin-3-yl)oxidanyl|4,4-Dimethyl-2-octyl-2-[7-oxo-7-[2-(trimethylammonio)ethoxy]heptyl]-3-oxazolidinyloxy|(4,4-Dimethyl-2-octyl-2-{7-oxo-7-[2-(trimethylazaniumyl)ethoxy]heptyl}-1,3-oxazolidin-3-yl)oxidanyl

CAS: 63404-83-1
Molecular Formula C25H50N2O4+
Molecular Weight 442.37704 g/mol
LogP 6.0
Topological Polar Surface Area 39.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 18
Exact Mass 442.37704
Monoisotopic Mass 442.37704
Heavy Atoms 31
Complexity 504.0

Chemical Identifiers

CAS Number 63404-83-1
SMILES CCCCCCCCC1(N(C(CO1)(C)C)[O])CCCCCCC(=O)OCC[N+](C)(C)C
InChIKey BMGKTDUWOAXQDJ-UHFFFAOYSA-N

Product Overview

8-Doxylpalmitoylcholine (CAS 63404-83-1), with molecular formula C25H50N2O4+ and molecular weight 442.37704 g/mol.

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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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