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Bisphenol F Bis(2-chloro-1-propanol) Ether(Mixture of Diastereomers)

Bisphenol F Bis(2-chloro-1-propanol) Ether(Mixture of Diastereomers)

Inquiry

Molecular Formula:

C19H22Cl2O4

Molecular Weight:

385.28

CAS Number:

374772-79-9

Catalog Number:

374772-79-9

Product Information

Molecular Formula:

C19H22Cl2O4

Molecular Weight:

385.28

Description

Applications: Bisphenol F Bis(2-chloro-1-propanol)ether is a derivative of Bisphenol F Diglycidyl Ether (BFDGE). Bisphenol F Bis(2-chloro-1-propanol)ether is used as a standard for determining toxic monomers released from polymers of the inner coating of cans.

Synonyms

3,3'-[Methylenebis(4,1-phenyleneoxy)]bis[2-chloro-1-propanol]||||BFDGE.2HCl

IUPAC Name

2-chloro-3-[4-[[4-(2-chloro-3-hydroxypropoxy)phenyl]methyl]phenoxy]propan-1-ol

Canonical SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)OCC(CO)Cl)OCC(CO)Cl

InChI

InChI=1S/C19H22Cl2O4/c20-16(10-22)12-24-18-5-1-14(2-6-18)9-15-3-7-19(8-4-15)25-13-17(21)11-23/h1-8,16-17,22-23H,9-13H2

InChI Key

VAFXFEBPCUMOIF-UHFFFAOYSA-N

Boiling Point

546.4±45.0 °C(Predicted)

Density

1.278±0.06 g/cm3(Predicted)

Appearance

White Solid

Storage

-20°C Freezer

Computed Properties

XLogP3

3.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

384.0895146 g/mol

Monoisotopic Mass

384.0895146 g/mol

Topological Polar Surface Area

58.9Å²

Heavy Atom Count

Formal Charge

Complexity

310

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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Bisphenol F Bis(2-chloro-1-propanol) Ether(Mixture of Diastereomers)

Product Information

Computed Properties

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