3-Formyl-2-methoxy-5-methylphenylboronic acid

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Molecular Formula:

C9H11BO4

Molecular Weight:

193.99

CAS Number:

480424-55-3

Catalog Number:

480424-55-3

Product Information

Molecular Formula:

C9H11BO4

Molecular Weight:

193.99

Description

3-Formyl-2-methoxy-5-methylphenylboronic acid (CAS# 480424-55-3) is a useful research chemical.

Synonyms

(3-formyl-2-methoxy-5-methylphenyl)boronic acid

IUPAC Name

(3-formyl-2-methoxy-5-methylphenyl)boronic acid

Canonical SMILES

B(C1=CC(=CC(=C1OC)C=O)C)(O)O

InChI

InChI=1S/C9H11BO4/c1-6-3-7(5-11)9(14-2)8(4-6)10(12)13/h3-5,12-13H,1-2H3

InChI Key

WDUHXJSEZPXEFU-UHFFFAOYSA-N

Boiling Point

424.1 °C at 760 mmHg

Melting Point

117-122 °C

Purity

98 %

Density

1.22 g/cm³

Appearance

White to tan crystalline powder

LogP

-0.50410

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

194.0750390 g/mol

Monoisotopic Mass

194.0750390 g/mol

Topological Polar Surface Area

66.8Å²

Heavy Atom Count

Formal Charge

Complexity

197

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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3-Formyl-2-methoxy-5-methylphenylboronic acid

Product Information

Computed Properties

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