CAS 453-71-4

4-Fluoro-3-nitrobenzoic acid

Description:

4-Fluoro-3-nitrobenzoic acid is an aromatic carboxylic acid characterized by the presence of both a fluoro and a nitro group on the benzene ring. Its molecular structure features a benzoic acid core, with a fluorine atom positioned at the para (4) position and a nitro group at the meta (3) position relative to the carboxylic acid group. This compound is typically a solid at room temperature and is known for its moderate solubility in polar solvents such as water and alcohols, while being less soluble in non-polar solvents. The presence of the electronegative fluorine and nitro groups contributes to its acidity and reactivity, making it useful in various chemical syntheses and applications, including pharmaceuticals and agrochemicals. Additionally, 4-Fluoro-3-nitrobenzoic acid can participate in electrophilic aromatic substitution reactions and can serve as a building block for more complex organic molecules. Safety precautions should be taken when handling this compound, as it may pose health risks if ingested or inhaled.

Formula: C₇H₄FNO₄

InChI: InChI=1S/C7H4FNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)

InChI key: InChIKey=BOJWTAQWPVBIPG-UHFFFAOYSA-N

SMILES: N(=O)(=O)C1=CC(C(O)=O)=CC=C1F

Synonyms:

• 1-Fluoro-4-(methylsulfonyl)-2-nitrobenzene
• 3-Nitro-4-fluorobenzoic acid
• 4-Carboxy-2-nitrofluorobenzene
• 4-Fluoro-3-Nitrobenzoate
• 4-Fluoro-3-nitrophenyl methyl sulfone
• Benzene, 1-fluoro-4-(methylsulfonyl)-2-nitro-
• Benzoic acid, 4-fluoro-3-nitro-
• NSC 10311
• Rarechem Al Bo 0969
• Timtec-Bb Sbb008336
• 4-Fluoro-3-nitrobenzoic acid

4-Fluoro-3-nitrobenzoic Acid

CAS: 453-71-4

Formula: C₇H₄FNO₄

Purity: >98.0%(GC)(T)

Color and Shape: White - Yellow Solid Form

Molecular weight: 185.11

Ref: 3B-F0399

4-Fluoro-3-nitrobenzoic acid, 98%

CAS: 453-71-4

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₇H₄FNO₄

Purity: 98%

Color and Shape: White to pale yellow to pale gray, Powder

Molecular weight: 185.11

Ref: 02-A10800

4-Fluoro-3-nitrobenzoic acid

CAS: 453-71-4

Formula: C₇H₄FNO₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 185.1094

Ref: IN-DA003416

4-Fluoro-3-nitrobenzoic acid

CAS: 453-71-4

4-Fluoro-3-nitrobenzoic acid

Formula: C₇H₄FNO₄

Purity: ≥95%

Color and Shape: off-white to faint yellow powder

Molecular weight: 185.11g/mol

Ref: 54-PC3935

4-Fluoro-3-nitrobenzoic acid

CAS: 453-71-4

4-Fluoro-3-nitrobenzoic acid (4FNBA) is a molecule that has been studied for its ability to inhibit the activity of amine oxidases and haloperoxidases. 4FNBA was shown to be a substrate for the model protein, with an equilibrium constant of 2.6 x 10^6 M^(-1). The conversion of 4FNBA to the corresponding quinoxalines was also observed. Molecular docking analysis revealed that 4FNBA binds to the chloride ion and hydrogen bond interactions with nitrogen and oxygen atoms in the protein. This molecule is structurally diverse and may be useful in chemical synthesis or as a drug for treating certain medical conditions.

Formula: C₇H₄FNO₄

Color and Shape: Powder

Molecular weight: 185.11 g/mol

Ref: 3D-FF23392

4-Fluoro-3-nitrobenzoic acid

CAS: 453-71-4

Formula: C₇H₄FNO₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 185.11

Ref: 10-F018022

4-Fluoro-3-nitrobenzoic Acid

Controlled Product

CAS: 453-71-4

Applications 4-Fluoro-3-nitrobenzoic Acid (cas# 453-71-4) is a compound useful in organic synthesis.

Formula: C₇H₄FNO₄

Color and Shape: Neat

Molecular weight: 185.11

Ref: TR-F593780