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2,4,6-Trimethoxyphenylboronic acid neopentyl glycol ester

2,4,6-Trimethoxyphenylboronic acid neopentyl glycol ester

Inquiry

Molecular Formula:

C14H21BO5

Molecular Weight:

280.12

Product Information

Molecular Formula:

C14H21BO5

Molecular Weight:

280.12

Description

2,4,6-Trimethoxyphenylboronic acid neopentyl glycol ester is a highly specialized and complex chemical compound, playing a distinctive role within the realm of biomedical cancer research. Its intrinsic potency derives from its utilized integration into the construction of therapeutics specifically targeting malignant cell propagation, thereby impelling an acute reduction in cancerous cell proliferation.

Synonyms

2-(2,4,6-Trimethoxyphenyl)-5,5-dimethyl-1,3,2-dioxaborinane

IUPAC Name

5,5-dimethyl-2-(2,4,6-trimethoxyphenyl)-1,3,2-dioxaborinane

Canonical SMILES

B1(OCC(CO1)(C)C)C2=C(C=C(C=C2OC)OC)OC

InChI

InChI=1S/C14H21BO5/c1-14(2)8-19-15(20-9-14)13-11(17-4)6-10(16-3)7-12(13)18-5/h6-7H,8-9H2,1-5H3

InChI Key

ALIYPFTURKMCNA-UHFFFAOYSA-N

Melting Point

105-109 °C

Purity

97%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

280.1482039 g/mol

Monoisotopic Mass

280.1482039 g/mol

Topological Polar Surface Area

46.2Å²

Heavy Atom Count

Formal Charge

Complexity

288

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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2,4,6-Trimethoxyphenylboronic acid neopentyl glycol ester

Product Information

Computed Properties

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