Bis[4-(2-hydroxyethoxy)phenyl] sulfone

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Molecular Formula:

C16H18O6S

Molecular Weight:

338.38

CAS Number:

27205-03-4

Catalog Number:

27205-03-4

Product Information

Molecular Formula:

C16H18O6S

Molecular Weight:

338.38

Description

Bis[4-(2-hydroxyethoxy)phenyl] sulfone is an eminent component employed in pharmaceutical formulations addressing an assortment of autoimmunity disorders, encompassing rheumatoid arthritis and lupus. Exhibiting profound anti-inflammatory prowess, it effectively mitigates symptoms and ameliorates general well-being. The compound specifically modulates designated immune system pathways and has significant anti-inflammatory activity.

Synonyms

2,2'-[Sulphonylbis(4,1-phenyleneoxy)]bisethanol; BIS[4-(2-HYDROXYETHOXY)PHENYL] SULFONE; 4-(2-HYDROXYETHOXY)PHENYL SULFONE; 4,4'-(2-HYDROXYLETHOXY)DIPHENYLSULFONE; 4,4'-(2-HYDROXYETHOXY)DIPHENYLSULFONE; Bishydroxyethoxyphenylsulfone

IUPAC Name

2-[4-[4-(2-hydroxyethoxy)phenyl]sulfonylphenoxy]ethanol

Canonical SMILES

C1=CC(=CC=C1OCCO)S(=O)(=O)C2=CC=C(C=C2)OCCO

InChI

InChI=1S/C16H18O6S/c17-9-11-21-13-1-5-15(6-2-13)23(19,20)16-7-3-14(4-8-16)22-12-10-18/h1-8,17-18H,9-12H2

InChI Key

UTNSTOOXQPHXJQ-UHFFFAOYSA-N

Boiling Point

582.5ºC at 760mmHg

Melting Point

179-183ºC(lit.)

Purity

>97.0%(GC)

Density

1.333g/cm3

Appearance

White to Almost white powder to crystal

Computed Properties

XLogP3

1.3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

338.08240946 g/mol

Monoisotopic Mass

338.08240946 g/mol

Topological Polar Surface Area

101Å²

Heavy Atom Count

Formal Charge

Complexity

382

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Bis[4-(2-hydroxyethoxy)phenyl] sulfone

Product Information

Computed Properties

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