2,4-Dipropoxyphenylboronic acid

Inquiry

Molecular Formula:

C12H19BO4

Molecular Weight:

238.1

CAS Number:

150145-25-8

Catalog Number:

150145-25-8

Product Information

Molecular Formula:

C12H19BO4

Molecular Weight:

238.1

Description

2,4-Dipropoxyphenylboronic acid is an important biomolecule in the pharmaceutical field, whose main function is to generate complex molecules decorated with one or a series of boronic acid functional groups.

Synonyms

(2,4-Dipropoxyphenyl)boronicacid; Boronic acid, (2,4-dipropoxyphenyl)- (9CI); 2,4-Dipropoxyphenylboronic acid, >=95%

IUPAC Name

(2,4-dipropoxyphenyl)boronic acid

Canonical SMILES

B(C1=C(C=C(C=C1)OCCC)OCCC)(O)O

InChI

InChI=1S/C12H19BO4/c1-3-7-16-10-5-6-11(13(14)15)12(9-10)17-8-4-2/h5-6,9,14-15H,3-4,7-8H2,1-2H3

InChI Key

ZNGNDOSZRKWKJW-UHFFFAOYSA-N

Melting Point

121-127 °C

Purity

96%

Appearance

White to tan powder or crystals

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

238.1376392 g/mol

Monoisotopic Mass

238.1376392 g/mol

Topological Polar Surface Area

58.9Å²

Heavy Atom Count

Formal Charge

Complexity

201

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)

Mass

Concentration

Volume

Molecular Weight *

Calculate

The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)

Calculate

2,4-Dipropoxyphenylboronic acid

Product Information

Computed Properties

Related Products