3,5-Dichlorobisphenol A

Inquiry

Molecular Formula:

C15H14Cl2O2

Molecular Weight:

297.18

CAS Number:

14151-65-6

Catalog Number:

14151-65-6

Product Information

Molecular Formula:

C15H14Cl2O2

Molecular Weight:

297.18

Description

Applications: 3,5-Dichlorobisphenol A is an chlorinated derivative of Bisphenol A (B519495), a monomer used for policarbonate and epoxy resins; exhibits estrogenic activity.

Synonyms

2,6-Dichloro-4,4'-isopropylidenediphenol||||2,6-dichloro-4-[1-(4-hydroxyphenyl)-1-methylethyl]phenol

IUPAC Name

2,6-dichloro-4-[2-(4-hydroxyphenyl)propan-2-yl]phenol

Canonical SMILES

CC(C)(C1=CC=C(C=C1)O)C2=CC(=C(C(=C2)Cl)O)Cl

InChI

InChI=1S/C15H14Cl2O2/c1-15(2,9-3-5-11(18)6-4-9)10-7-12(16)14(19)13(17)8-10/h3-8,18-19H,1-2H3

InChI Key

ZUPWAEAGAFKCJG-UHFFFAOYSA-N

Boiling Point

399.0±37.0 °C(Predicted)

Melting Point

100-101 °C

Density

1.329±0.06 g/cm3(Predicted)

Appearance

White to Off-White Solid

Storage

Room Temp

Computed Properties

XLogP3

5.3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

296.0370851 g/mol

Monoisotopic Mass

296.0370851 g/mol

Topological Polar Surface Area

40.5Å²

Heavy Atom Count

Formal Charge

Complexity

289

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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Volume _(start)

Concentration _(final)

Volume _(final)

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3,5-Dichlorobisphenol A

Product Information

Computed Properties

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