2-tert-Butoxymethylphenylboronic acid

Inquiry

Molecular Formula:

C11H17BO3

Molecular Weight:

208.06

Product Information

Molecular Formula:

C11H17BO3

Molecular Weight:

208.06

Description

2-tert-Butoxymethylphenylboronic acid is an indispensable reagent in biomedicine and holds great promise for combating diverse ailments. Its extensive application in drug discovery, synthesis, and pharmaceutical research signifies its crucial role in these fields. The compound's remarkable potential lies in its ability to inhibit specific enzymes implicated in cancer advancement, rendering it a prime contender for targeted cancer therapy. Moreover, it exhibits auspicious prospects as a pivotal constituent in formulating groundbreaking medications for alleviating inflammation, diabetes, and associated pathologies.

Synonyms

[2-[(2-methylpropan-2-yl)oxymethyl]phenyl]boronic Acid; 2-tert-Butoxymethylphenylboronic acid; 2-tetr-Butoxymethylphenylboronic acid; (2-(tert-Butoxymethyl)phenyl)boronic acid; [2-(tert-butoxymethyl)phenyl]boronic acid; 2-tert-butoxymethylbenzeneboronic acid; 2-(tert-Butoxymethyl)benzeneboronicacid

IUPAC Name

[2-[(2-methylpropan-2-yl)oxymethyl]phenyl]boronic acid

Canonical SMILES

B(C1=CC=CC=C1COC(C)(C)C)(O)O

InChI

InChI=1S/C11H17BO3/c1-11(2,3)15-8-9-6-4-5-7-10(9)12(13)14/h4-7,13-14H,8H2,1-3H3

InChI Key

MKTUWARSDLQBAL-UHFFFAOYSA-N

Flash Point

Not applicable

Safety Information

Hazards

H302

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

208.1270746 g/mol

Monoisotopic Mass

208.1270746 g/mol

Topological Polar Surface Area

49.7Å²

Heavy Atom Count

Formal Charge

Complexity

189

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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2-tert-Butoxymethylphenylboronic acid

Product Information

Safety Information

Computed Properties

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