Diethyl 4-(trifluoromethyl)benzylphosphonate

Inquiry

Product Information

Molecular Formula
C12H16F3O3P
Molecular Weight
296.22
Description
Diethyl 4-(trifluoromethyl)benzylphosphonate (CAS# 99578-68-4 ) is a useful research chemical.
Synonyms
1-(diethoxyphosphorylmethyl)-4-(trifluoromethyl)benzene
IUPAC Name
1-(diethoxyphosphorylmethyl)-4-(trifluoromethyl)benzene
SMILES
CCOP(=O)(CC1=CC=C(C=C1)C(F)(F)F)OCC
InChI
InChI=1S/C12H16F3O3P/c1-3-17-19(16,18-4-2)9-10-5-7-11(8-6-10)12(13,14)15/h5-8H,3-4,9H2,1-2H3
InChI Key
NTQKMIQYHZLRSW-UHFFFAOYSA-N
Flash Point
Not applicable
Purity
97 %
Density
1.227 g/mL at 25 °C
Refractive Index
n20/D 1.456
LogP
4.47150

Computed Properties

XLogP3
2.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
6
Exact Mass
296.07891585 g/mol
Monoisotopic Mass
296.07891585 g/mol
Topological Polar Surface Area
35.5Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
302
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

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

Calculate
The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

Calculate

Related Products

Polymer Applications

Automotive polymer materials
Automotive

BOC Sciences can provide a wide variety of raw materials from upstream lines for automotive parts manufacturing, such as monomers, polymers and additives.

Explore Automotive Materials
Composites polymer materials
Composites

BOC Sciences supplies the necessary raw materials to help you manufacture ideal composites.

Explore Composites Materials
Healthcare polymer materials
Healthcare

BOC Sciences can help our customers further understand the functionality and applicable requirements for raw materials in different healthcare segments.

Explore Healthcare Materials
Electronics polymer materials
Electronics

BOC Sciences' seasoned experts can help you from upstream lines to arrive at the most appropriate solution to improve production and optimize your bottom line.

Explore Electronics Materials
Packaging polymer materials
Packaging

BOC Sciences can help you arrive at an optimal solution to improve your research projects and manufacturing process.

Explore Packaging Materials

Customer Support

BOC Sciences customer support team
International
US & Canada (Toll free)

Ask a Question

Online Inquiry

  • Verification code
Top
Inquiry Basket
Loading......
Delete selected Go to checkout