4-(isobutylaminocarbonyl)phenylboronic acid

Inquiry

Molecular Formula:

C11H16BNO3

Molecular Weight:

221.06

Product Information

Molecular Formula:

C11H16BNO3

Molecular Weight:

221.06

Description

Potent as an inhibitor of proteasome activity, 4-(Isobutylaminocarbonyl)phenylboronic acid exhibits promising prospects in countering cancer and engendering targeted drug conveyance mechanisms.

Synonyms

[4-(2-methylpropylcarbamoyl)phenyl]boronic Acid; 4-(Isobutylaminocarbonyl)benzeneboronic acid; 4-(isobutylcarbamoyl)phenylboronic acid; Boronic acid, [4-[[(2-methylpropyl)amino]carbonyl]phenyl]-; {4-[(2-Methylpropyl)carbamoyl]phenyl}boronic acid; (4-(Isobutylcarbamoyl)phenyl)boronic acid; 4-(Isobutylaminocarbonyl)phenylboronic acid; 4-BORONO-N-ISOBUTYLBENZAMIDE; (4-(Isobutylcarbamoyl)phenyl)boronicacid; (4-{[(2-methylpropyl)amino]carbonyl}phenyl)boronic acid; 4-(isobutylaminocarbonyl)phenylboronic acid

IUPAC Name

[4-(2-methylpropylcarbamoyl)phenyl]boronic acid

Canonical SMILES

B(C1=CC=C(C=C1)C(=O)NCC(C)C)(O)O

InChI

InChI=1S/C11H16BNO3/c1-8(2)7-13-11(14)9-3-5-10(6-4-9)12(15)16/h3-6,8,15-16H,7H2,1-2H3,(H,13,14)

InChI Key

DUBSEAOPNSRHHN-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

221.1223235 g/mol

Monoisotopic Mass

221.1223235 g/mol

Topological Polar Surface Area

69.6Å²

Heavy Atom Count

Formal Charge

Complexity

225

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-(isobutylaminocarbonyl)phenylboronic acid

Product Information

Safety Information

Computed Properties

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