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5-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-1-propyl-1H-pyrazole

5-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-1-propyl-1H-pyrazole

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Molecular Formula:

C11H19BN2O2

Molecular Weight:

222.09

Product Information

Molecular Formula:

C11H19BN2O2

Molecular Weight:

222.09

Description

5-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-1-propyl-1H-pyrazole is an immensely influential and paradigm-shifting biomedical entity that holds immense potential in alleviating multifarious afflictions. This extraordinary therapeutic agent, owing to its distinctive molecular configuration, possesses remarkable prowess in precisely targeting and obstructing specific enzymes implicated in the advancement of oncological and inflammatory maladies.

Synonyms

5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1-propylpyrazole; 5-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-1-propyl-1H-pyrazole

IUPAC Name

5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1-propylpyrazole

Canonical SMILES

B1(OCC(CO1)(C)C)C2=CC=NN2CCC

InChI

InChI=1S/C11H19BN2O2/c1-4-7-14-10(5-6-13-14)12-15-8-11(2,3)9-16-12/h5-6H,4,7-9H2,1-3H3

InChI Key

FFTMJZDZNIVUSW-UHFFFAOYSA-N

Flash Point

Not applicable

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

222.1539580 g/mol

Monoisotopic Mass

222.1539580 g/mol

Topological Polar Surface Area

36.3Å²

Heavy Atom Count

Formal Charge

Complexity

228

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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5-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-1-propyl-1H-pyrazole

Product Information

Computed Properties

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