4-(N-propylaminocarbonyl)phenylboronic acid

Inquiry

Molecular Formula:

C10H14BNO3

Molecular Weight:

207.03

Product Information

Molecular Formula:

C10H14BNO3

Molecular Weight:

207.03

Description

4-(N-propylaminocarbonyl)phenylboronic acid selectively modulates enzymes and pathways involved in these diseases, including but not limited to cancer, diabetes, and arthritis.

Synonyms

4-(Propylcarbamoyl)phenyl)boronic acid; [4-(propylcarbamoyl)phenyl]boronic Acid; 4-(propylcarbamoyl)phenylboronic acid; 4-(N-PROPYLCARBAMOYL)BENZENEBORONIC ACID; N-PROPYL 4-BORONOBENZAMIDE; (4-(Propylcarbamoyl)phenyl)boronicacid; 4-(N-propylaminocarbonyl)phenylboronic acid; 1H-Imidazole-1,2-diamine,4-phenyl-N1-(phenylmethylene)-

IUPAC Name

[4-(propylcarbamoyl)phenyl]boronic acid

Canonical SMILES

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

InChI

InChI=1S/C10H14BNO3/c1-2-7-12-10(13)8-3-5-9(6-4-8)11(14)15/h3-6,14-15H,2,7H2,1H3,(H,12,13)

InChI Key

KWJCBWYHJKWCRD-UHFFFAOYSA-N

Flash Point

Not applicable

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

207.1066735 g/mol

Monoisotopic Mass

207.1066735 g/mol

Topological Polar Surface Area

69.6Å²

Heavy Atom Count

Formal Charge

Complexity

203

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-(N-propylaminocarbonyl)phenylboronic acid

Product Information

Computed Properties

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