[4-Methoxy-2-(1H-pyrazol-1-yl)phenyl]boronic acid

Inquiry

Molecular Formula:

C10H11BN2O3

Molecular Weight:

218.02

Product Information

Molecular Formula:

C10H11BN2O3

Molecular Weight:

218.02

Description

4-Methoxy-2-(1H-pyrazol-1-yl)phenyl]boronic acid is a pharmaceutical intermediate extensively used in biomedical research. It plays a critical role in the synthesis of potential therapeutic agents for neurodegenerative diseases, particularly Parkinson's disease, due to its properties of binding and activating dopamine receptors.

Synonyms

(4-Methoxy-2-(1H-pyrazol-1-yl)phenyl)boronic acid; (4-methoxy-2-pyrazol-1-ylphenyl)boronic acid; boronic acid, [4-methoxy-2-(1H-pyrazol-1-yl)phenyl]-; [4-Methoxy-2-(1H-pyrazol-1-yl)phenyl]boronic acid

IUPAC Name

(4-methoxy-2-pyrazol-1-ylphenyl)boronic acid

Canonical SMILES

B(C1=C(C=C(C=C1)OC)N2C=CC=N2)(O)O

InChI

InChI=1S/C10H11BN2O3/c1-16-8-3-4-9(11(14)15)10(7-8)13-6-2-5-12-13/h2-7,14-15H,1H3

InChI Key

HNIWENQDOKNTLY-UHFFFAOYSA-N

Flash Point

Not applicable

Safety Information

Hazards

H318

Precautionary Statement

P280 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

218.0862724 g/mol

Monoisotopic Mass

218.0862724 g/mol

Topological Polar Surface Area

67.5Å²

Heavy Atom Count

Formal Charge

Complexity

230

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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[4-Methoxy-2-(1H-pyrazol-1-yl)phenyl]boronic acid

Product Information

Safety Information

Computed Properties

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