3-Bromo-5-(4-hydroxyphenyl)phenol

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Molecular Formula:

C12H9BrO2

Molecular Weight:

265.1

CAS Number:

1261956-89-1

Catalog Number:

1261956-89-1

Product Information

Molecular Formula:

C12H9BrO2

Molecular Weight:

265.1

Description

Applications: 3-Bromo-5-(4-hydroxyphenyl)phenol

Synonyms

5-Bromo[1,1'-biphenyl]-3,4'-diol; 5-BROMO-[1,1'-BIPHENYL]-3,4'-DIOL;

IUPAC Name

3-bromo-5-(4-hydroxyphenyl)phenol

Canonical SMILES

C1=CC(=CC=C1C2=CC(=CC(=C2)Br)O)O

InChI

InChI=1S/C12H9BrO2/c13-10-5-9(6-12(15)7-10)8-1-3-11(14)4-2-8/h1-7,14-15H

InChI Key

UKXYKVZENKLOBL-UHFFFAOYSA-N

Boiling Point

412.2±35.0 °C(Predicted)

Density

1.580±0.06 g/cm3(Predicted)

Computed Properties

XLogP3

3.5

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

263.97859 g/mol

Monoisotopic Mass

263.97859 g/mol

Topological Polar Surface Area

40.5Å²

Heavy Atom Count

Formal Charge

Complexity

202

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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3-Bromo-5-(4-hydroxyphenyl)phenol

Product Information

Computed Properties

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