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4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid hydrochloride

4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid hydrochloride

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Molecular Formula:

C12H18BClN2O3

Molecular Weight:

284.55

Product Information

Molecular Formula:

C12H18BClN2O3

Molecular Weight:

284.55

Description

4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid hydrochloride possesses extraordinary versatility, rendering it indispensable within the realm of biomedicine. Serving as a pivotal intermediary in the chemical synthesis of pharmaceutical agents for multifarious ailments, this product emerges as an irreplaceable contributor to the pharmaceutical landscape. Facilitating the efficacy of drugs that target discrete receptors or enzymes, it wields paramount significance in ameliorating an extensive gamut of disorders and conditions.

Synonyms

N-4-Methylpiperazinyl 4-boronobenzamide hydrochloride; (4-(4-methylpiperazine-1-carbonyl)phenyl)boronic acid hydrochloride; (4-((4-METHYLPIPERAZIN-1-YL)CARBAMOYL)PHENYL)BORONIC ACID HCL; 4-[(4-Methylpiperazin-1-yl)carbonyl]benzeneboronic acid hydrochloride; [4-(4-Methylpiperazine-1-carbonyl)phenyl]boronic acid--hydrogen chloride (1/1); 4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid hydrochloride; Boronicacid,b-[4-[(4-methyl-1-piperazinyl)carbonyl]phenyl]-,hydrochloride(1:1)

IUPAC Name

[4-(4-methylpiperazine-1-carbonyl)phenyl]boronic acidhydrochloride

Canonical SMILES

B(C1=CC=C(C=C1)C(=O)N2CCN(CC2)C)(O)O.Cl

InChI

InChI=1S/C12H17BN2O3.ClH/c1-14-6-8-15(9-7-14)12(16)10-2-4-11(5-3-10)13(17)18/h2-5,17-18H,6-9H2,1H31H

InChI Key

OUEWYSQRULKJEQ-UHFFFAOYSA-N

Flash Point

Not applicable

Safety Information

Hazards

H319

Precautionary Statement

P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

284.1099003 g/mol

Monoisotopic Mass

284.1099003 g/mol

Topological Polar Surface Area

64Å²

Heavy Atom Count

Formal Charge

Complexity

285

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-(4-Methylpiperazine-1-carbonyl)phenylboronic acid hydrochloride

Product Information

Safety Information

Computed Properties

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