O-(Octylphosphoryl)choline solution

Product Information

Molecular Formula:
C13H30NO4P
Molecular Weight:
295.36
Description
Zwitterionic detergent used for protein solubilization
Synonyms
Detergent Screening Solution 33/Fluka kit no 66317, Phosphocholine octyl ester
IUPAC Name
octyl 2-(trimethylazaniumyl)ethyl phosphate
Canonical SMILES
CCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C
InChI
InChI=1S/C13H30NO4P/c1-5-6-7-8-9-10-12-17-19(15,16)18-13-11-14(2,3)4/h5-13H2,1-4H3
InChI Key
MDNHUELOANFCGT-UHFFFAOYSA-N
Flash Point
230 °F
Purity
≥97.0% (dried material, CHN)
Appearance
Pale yellow clear solution
Storage
2-8°C

Computed Properties

XLogP3
2.4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
12
Exact Mass
295.19124544 g/mol
Monoisotopic Mass
295.19124544 g/mol
Topological Polar Surface Area
58.6Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
258
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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