3-borono-2-thiophenecarboxylic acid

Inquiry

Molecular Formula:

C5H5BO4S

Molecular Weight:

171.97

Product Information

Molecular Formula:

C5H5BO4S

Molecular Weight:

171.97

Description

3-borono-2-thiophenecarboxylic acid is a potent pharmaceutical intermediate widely used in the biomedicine field. It exhibits promising anti-cancer properties, specifically against breast, prostate, and colon cancers. This versatile compound can also serve as a valuable tool for drug synthesis and development.

Synonyms

2-Carboxythiophene-3-boronic acid; 3-BORONOTHIOPHENE-2-CARBOXYLIC ACID; 3-BORONO-2-THIOPHENECARBOXYLIC ACID; 3-(DIHYDROXYBORANYL)THIOPHENE-2-CARBOXYLIC ACID; 2-Thiophenecarboxylicacid, 3-borono-; SCHEMBL1372166; 2-Carboxy-3-thienylboronic acid; 3-BORONOTHIOPHENE-2-CARBOXYLICACID; 3-(dihydroxyboryl)thiophene-2-carboxylic acid 3-borono-2-thiophenecarboxylic acid

IUPAC Name

3-boronothiophene-2-carboxylic acid

Canonical SMILES

B(C1=C(SC=C1)C(=O)O)(O)O

InChI

InChI=1S/C5H5BO4S/c7-5(8)4-3(6(9)10)1-2-11-4/h1-2,9-10H,(H,7,8)

InChI Key

AJNCKPIBBSWSBY-UHFFFAOYSA-N

Flash Point

Not applicable

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

172.0001600 g/mol

Monoisotopic Mass

172.0001600 g/mol

Topological Polar Surface Area

106Å²

Heavy Atom Count

Formal Charge

Complexity

163

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-borono-2-thiophenecarboxylic acid

Product Information

Computed Properties

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