Pentaerythritol ethoxylate (3/4 EO/OH)

Product Information

Molecular Formula:
C[CH2(OCH2CH2)nOH]4
Molecular Weight:
312.36
Description
Pentaerythritol ethoxylate (3/4 EO/OH) is a hydroxypolyether in which a hydroxy-poly(ethylene oxide) chain is connected to each of the methyl groups of neopentane. It is commonly used to crystallise proteins. It has a role as a crystallisation adjutant.
Synonyms
Pentaerythritol ethoxylate
IUPAC Name
2-[3-(2-hydroxyethoxy)-2,2-bis(2-hydroxyethoxymethyl)propoxy]ethanol
Canonical SMILES
C(COCC(COCCO)(COCCO)COCCO)O
InChI
InChI=1S/C13H28O8/c14-1-5-18-9-13(10-19-6-2-15,11-20-7-3-16)12-21-8-4-17/h14-17H,1-12H2
InChI Key
RRQXXKCYECDESZ-UHFFFAOYSA-N
Flash Point
>235.4 °F
Purity
95% (GC)
Density
1.2 g/mL at 25 °C (lit.)
Storage
2-8°C
Tg
powder

Safety Information

Handling
Eyeshields, Gloves

Computed Properties

XLogP3
-3
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
8
Rotatable Bond Count
16
Exact Mass
312.17841785 g/mol
Monoisotopic Mass
312.17841785 g/mol
Topological Polar Surface Area
118Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
169
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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