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Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl] sulfone

Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl] sulfone

Name: Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl] sulfone
Brand: BOC Sciences
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Molecular Formula:

C16H14Br4O6S

Molecular Weight:

653.96

CAS Number:

53714-39-9

Catalog Number:

53714-39-9

Product Information

Molecular Formula:

C16H14Br4O6S

Molecular Weight:

653.96

Description

Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl] sulfone, commonly known as BDHS, is a highly significant biomedical compound extensively utilized in the drug development of cutaneous disorders such as leprosy and acne. Boasting remarkable antimicrobial and anti-inflammatory attributes, this dynamic constituent facilitates the abatement of bacterial proliferation and suppression of inflammation commonly attributed to the aforementioned dermatological conditions.

Synonyms

DIHYDROXYETHYL ETHER TETRABROMO-4,4'-SULFONYLDIPHENOL; BIS[3,5-DIBROMO-4-(2-HYDROXYETHOXY)PHENYL] SULFONE; BIS[4-(2-HYDROXYETHOXY)-3,5-DIBROMOPHENYL] SULFONE; Bishydroxyethoxydibromophenylsulfone; 2,2'-[sulphonylbis[(2,6-dibromo-4,1-phenylene)oxy]]bisethanol

IUPAC Name

2-[2,6-dibromo-4-[3,5-dibromo-4-(2-hydroxyethoxy)phenyl]sulfonylphenoxy]ethanol

Canonical SMILES

C1=C(C=C(C(=C1Br)OCCO)Br)S(=O)(=O)C2=CC(=C(C(=C2)Br)OCCO)Br

InChI

InChI=1S/C16H14Br4O6S/c17-11-5-9(6-12(18)15(11)25-3-1-21)27(23,24)10-7-13(19)16(14(20)8-10)26-4-2-22/h5-8,21-22H,1-4H2

InChI Key

OFBQIWFJRDGFEK-UHFFFAOYSA-N

Purity

>96.0%(GC)

Appearance

White to Almost white powder to crystal

Computed Properties

XLogP3

4.1

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

653.72036 g/mol

Monoisotopic Mass

649.72446 g/mol

Topological Polar Surface Area

101Å²

Heavy Atom Count

Formal Charge

Complexity

494

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)-3,5-dibromophenyl] sulfone

Product Information

Computed Properties

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