3-Fluoro-4-(methylsulfonyl)phenylboronic acid

Inquiry

Molecular Formula:

C7H8BFO4S

Molecular Weight:

218.01

Product Information

Molecular Formula:

C7H8BFO4S

Molecular Weight:

218.01

Description

3-Fluoro-4-(methylsulfonyl)phenylboronic acid is a pivotal ingredient in the biomedical sector. Functions as a fundamental building block and reactant, it finds its significance in the creation and production of groundbreaking pharmaceutical compounds. By selectively addressing distinct enzymatic activities or protein receptors, this compound manifests a promising stance in ameliorating diverse ailments. Its exceptional chemical attributes and adaptability to medicinal chemistry instances astoundingly facilitate extensive adoption within drug exploration and advancement endeavors.

Synonyms

(3-Fluoro-4-(methylsulfonyl)phenyl)boronic acid; 3-Fluoro-4-(methylsulphonyl)benzeneboronic acid; (3-fluoro-4-methylsulfonylphenyl)boronic acid; Boronic acid, [3-fluoro-4-(methylsulfonyl)phenyl]-; (3-fluoro-4-methanesulfonylphenyl)boronic acid; 3-Fluoro-4-(methylsulfonyl)phenylboronicAcid; SCHEMBL520332; 3-fluoro-4-(methanesulfonyl)phenyl-boronic acid; [3-Fluoro-4-(methanesulfonyl)phenyl]boronic acid; 3-Fluoro-4-(methylsulfonyl)phenylboronic acid

IUPAC Name

(3-fluoro-4-methylsulfonylphenyl)boronic acid

Canonical SMILES

B(C1=CC(=C(C=C1)S(=O)(=O)C)F)(O)O

InChI

InChI=1S/C7H8BFO4S/c1-14(12,13)7-3-2-5(8(10)11)4-6(7)9/h2-4,10-11H,1H3

InChI Key

RJKFNKNDTBNEST-UHFFFAOYSA-N

Flash Point

Not applicable

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

218.0220382 g/mol

Monoisotopic Mass

218.0220382 g/mol

Topological Polar Surface Area

83Å²

Heavy Atom Count

Formal Charge

Complexity

287

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

Patents

Publication Number	Title	Priority Date
US-2020345699-A1	Hiv protease inhibitors	2019-04-17
WO-2020214716-A1	2-imino-5-oxo-imidazolidine inhibitors of hiv protease	2019-04-17
EP-3955921-A1	2-imino-5-oxo-imidazolidine inhibitors of hiv protease	2019-04-17
KR-20200060269-A	Novel tricyclic compound as IRAK4 inhibitors	2018-11-21
WO-2020106059-A1	Novel tricyclic compound as irak4 inhibitor	2018-11-21
EP-3885348-A1	Novel tricyclic compound as irak4 inhibitor	2018-11-21
JP-2022507858-A	A novel tricyclic compound as an IRAK4 inhibitor	2018-11-21
KR-102329235-B1	Novel tricyclic compound as IRAK4 inhibitors	2018-11-21
US-2022009933-A1	Novel tricyclic compound as irak4 inhibitor	2018-11-21
US-2019076401-A1	Cyanoindazole compounds and uses thereof	2017-09-08

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-Fluoro-4-(methylsulfonyl)phenylboronic acid

Product Information

Computed Properties

Patents

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