3-BUTOXY-2,4,6-TRIFLUOROPHENYLBORONIC A&

Inquiry

Molecular Formula:

C10H12BF3O3

Molecular Weight:

248.007

CAS Number:

871126-23-7

Catalog Number:

871126-23-7

Product Information

Molecular Formula:

C10H12BF3O3

Molecular Weight:

248.007

Description

3-BUTOXY-2,4,6-TRIFLUOROPHENYLBORONIC ACID, an exceptional biocompatible agent, has garnered immense attention for its remarkable efficacy in combatting a myriad of ailments and afflictions. Its indispensability lies not only in its role as a pharmaceutical intermediate facilitating the synthesis of organic compounds, but also in enabling the advent of groundbreaking therapeutics that tackle neoplastic growth, inflammatory processes, and an array of associated pathologies.

Synonyms

(3-Butoxy-2,4,6-trifluorophenyl)boronic acid; 3-Butoxy-2,4,6-trifluorophenylboronic acid; 3-BUTOXY-2,4,6-TRIFLUOROPHENYLBORONIC A&; (3-Butoxy-2,4,6-trifluorophenyl)boronicacid

IUPAC Name

(3-butoxy-2,4,6-trifluorophenyl)boronic acid

Canonical SMILES

B(C1=C(C(=C(C=C1F)F)OCCCC)F)(O)O

InChI

InChI=1S/C10H12BF3O3/c1-2-3-4-17-10-7(13)5-6(12)8(9(10)14)11(15)16/h5,15-16H,2-4H2,1H3

InChI Key

ZSXDVYMTOUGRDJ-UHFFFAOYSA-N

Boiling Point

351.2°C at 760 mmHg

Melting Point

117-123°C

Purity

98%

Density

1.28g/cm3

Appearance

White to tan powder, crystals, crystalline powder and/or chunks

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

248.0831589 g/mol

Monoisotopic Mass

248.0831589 g/mol

Topological Polar Surface Area

49.7Å²

Heavy Atom Count

Formal Charge

Complexity

233

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-BUTOXY-2,4,6-TRIFLUOROPHENYLBORONIC A&

Product Information

Computed Properties

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