CAS 171050-06-9

3-Cyano-4-fluorobenzoic acid

Description:

3-Cyano-4-fluorobenzoic acid is an aromatic compound characterized by the presence of a cyano group (-CN) and a fluorine atom (-F) attached to a benzoic acid structure. This compound features a carboxylic acid functional group (-COOH), which contributes to its acidic properties. The cyano group introduces a strong electron-withdrawing effect, enhancing the compound's reactivity and influencing its solubility in various solvents. The fluorine atom, being highly electronegative, can also affect the compound's polarity and intermolecular interactions. Typically, 3-cyano-4-fluorobenzoic acid is utilized in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Its unique functional groups make it a valuable building block in the development of more complex molecules. Additionally, the compound's stability and reactivity can be influenced by environmental conditions, such as pH and temperature, which are important considerations in its handling and application in chemical processes.

Formula: C₈H₄FNO₂

InChI: InChI=1/C8H4FNO2/c9-7-2-1-5(8(11)12)3-6(7)4-10/h1-3H,(H,11,12)

SMILES: c1cc(c(cc1C(=O)O)C#N)F

Synonyms:

• Benzoic Acid, 3-Cyano-4-Fluoro-
• Qvr Df Ccn [Wln]

3-Cyano-4-fluorobenzoic acid

CAS: 171050-06-9

Formula: C₈H₄FNO₂

Purity: 97%

Color and Shape: Solid

Molecular weight: 165.1213

Ref: IN-DA00AB0L

3-Cyano-4-fluorobenzoic acid

CAS: 171050-06-9

3-Cyano-4-fluorobenzoic acid

Formula: C₈H₄FNO₂

Purity: ≥95%

Color and Shape: White-Pale Yellow Powder

Molecular weight: 165.12g/mol

Ref: 54-PC6131

3-Cyano-4-fluorobenzoic acid

CAS: 171050-06-9

3-Cyano-4-fluorobenzoic acid is a fluorinated analog of 3-cyano-4-fluorobenzoic acid, which has been shown to be effective in the treatment of prostate cancer. It is a prodrug that is metabolized by activated esterases to release the active form. The 18F radiolabeled form of 3-Cyano-4-fluorobenzoic acid has a high affinity for prostate carcinoma cells and has been used as a diagnostic agent. This drug also has an excellent pharmacokinetic profile and can be used as a nonradioactive tracer for imaging tumor cells in vivo.

Formula: C₈H₄FNO₂

Purity: Min. 95%

Color and Shape: White To Off-White Solid

Molecular weight: 165.12 g/mol

Ref: 3D-FC11266

3-Cyano-4-fluorobenzoic acid

CAS: 171050-06-9

Formula: C₈H₄FNO₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 165.123

Ref: 10-F209388