808740-52-5

Basic information

• Product Name: 3-(2-FLUORO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE
• Synonyms: 3-(2-FLUORO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE;5-Isoxazolecarboxaldehyde, 3-(2-fluorophenyl)-;3-(2-fluorophenyl)-1,2-oxazole-5-carbaldehyde;3-(2-Fluorophenyl)-5-isoxazolecarboxaldehyde
• CAS NO: 808740-52-5
• Molecular Formula: C₁₀H₆FNO₂
• Molecular Weight: 191.16
• Mol File: 808740-52-5.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 350.2 °C at 760 mmHg
• Flash Point: 165.6 °C
• Appearance: /
• Density: 1.303 g/cm³
• Vapor Pressure: 4.45E-05mmHg at 25°C
• Refractive Index: 1.568
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 3-(2-FLUORO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(2-FLUORO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE(808740-52-5)
• EPA Substance Registry System: 3-(2-FLUORO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE(808740-52-5)

Safety Data

• Hazard Codes: Xn
• Statements: 22
• Hazardous Substances Data: 808740-52-5(Hazardous Substances Data)

Usage

General Description

3-(2-Fluoro-phenyl)-isoxazole-5-carbaldehyde is a chemical compound with the molecular formula C9H6FNO2. It is an isoxazole derivative with a phenyl ring substituted with a fluorine atom. The aldehyde group at the 5-position of the isoxazole ring makes this compound highly reactive and useful in various organic synthesis processes. It is also used as a building block in the preparation of pharmaceuticals and agrochemicals. Additionally, its unique structure makes it a potential candidate for drug discovery and development. The compound's properties and reactivity make it a versatile chemical with potential applications in the pharmaceutical and agricultural industries.

InChI:InChI=1/C10H6FNO2/c11-9-4-2-1-3-8(9)10-5-7(6-13)14-12-10/h1-6H

Upstream product

• 953046-62-3 [3-(2-fluorophenyl)isoxazol-5-yl]methanol 
• 24652-66-2 2-fluorobenzaldehyde oxime 
• 446-52-6 2-Fluorobenzaldehyde 

Downstream Products

• 1337539-57-7 C₂₆H₃₀F₂N₄O 
• 1337539-61-3 C₂₆H₃₀ClFN₄O 
• 1337539-51-1 C₂₆H₃₁FN₄O 
• 1337539-65-7 C₂₆H₃₀ClFN₄O 
• 1337539-68-0 C₂₇H₃₃FN₄O₂ 
• 1337539-72-6 C₂₆H₃₀F₂N₄O 
• 1337539-73-7 C₃₃H₃₅F₃N₄O 
• 1337539-74-8 C₂₇H₃₃FN₄O 
• 1337539-75-9 C₂₆H₃₀ClFN₄O 
• 953046-63-4 1-(3-(2-fluorophenyl)isoxazol-5-yl)methylpiperazine 

Relevant articles and documents

A rapid and efficient solvent-free microwave-assisted synthesis of pyrazolone derivatives containing substituted isoxazole ring

An efficient synthesis of 4-substituted pyrazolone derivatives was developed. 4-Substituted pyrazolone derivatives were synthesized in 78-97% yields starting from various 3-substituted isoxazole-5-carbaldehydes, ethyl acetoacetate and hydrazine under micr

Synthesis and biological evaluation of focused isoxazolylpiperidinylpiperazine Library for dopamine D3 and D 4 Receptor antagonists

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Synthesis and biological evaluation of novel T-type Ca2+ channel blockers

A small molecule library of piperazinylalkylisoxazole derivatives containing about 600 compounds was designed, synthesized and evaluated for blocking effects on T-type Ca2+ channel. Several ligands were identified to possess high inhibitory activity against the T-type Ca 2+ channel. The compound 21 with trifluoromethyl substituents at C3-position of phenyl group (R1) and C2- position of phenyl group (R2) showed the highest inhibitory activity with IC50 value of 1.02μM, which is comparable to that of mibefradil.