54593-26-9

Basic information

• Product Name: 3,5-DIMETHYL-4-ISOXAZOLECARBALDEHYDE
• Synonyms: BUTTPARK 97\06-58;3,5-DIMETHYL-4-ISOXAZOLECARBOXALDEHYDE;3,5-DIMETHYL-4-FORMYLISOXAZOLE;3,5-DIMETHYL-4-ISOXAZOLECARBALDEHYDE;3,5-DIMETHYL-ISOXAZOLE-4-CARBALDEHYDE;AKOS PAO-1553;3,5-Dimethylisoxazole-4-carboxaldehyde;3,5-Dimethyl-4-isoxazolecarbaldehyde ,97%
• CAS NO: 54593-26-9
• Molecular Formula: C₆H₇NO₂
• Molecular Weight: 125.13
• Product Categories: Oxazole&Isoxazole;Aldehyde;Building Blocks;Isoxazole
• Mol File: 54593-26-9.mol
• Article Data: 9

Chemical Properties

• Melting Point: 54-56°C
• Boiling Point: 54-56
• Flash Point: 96.4 °C
• Appearance: /Solid
• Density: 1.14 g/cm³
• Vapor Pressure: 0.0492mmHg at 25°C
• Refractive Index: 1.514
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• PKA: -2.50±0.28(Predicted)
• CAS DataBase Reference: 3,5-DIMETHYL-4-ISOXAZOLECARBALDEHYDE(CAS DataBase Reference)
• NIST Chemistry Reference: 3,5-DIMETHYL-4-ISOXAZOLECARBALDEHYDE(54593-26-9)
• EPA Substance Registry System: 3,5-DIMETHYL-4-ISOXAZOLECARBALDEHYDE(54593-26-9)

Safety Data

• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 24/25
• HazardClass: IRRITANT
• Hazardous Substances Data: 54593-26-9(Hazardous Substances Data)

Usage

Chemical Properties

Off-white solid

InChI:InChI=1/C6H7NO2/c1-4-6(3-8)5(2)9-7-4/h3H,1-2H3

Upstream product

• 55727-23-6 3‐(1,3-dithiane-2-yl)pentane-2,4-dione 
• 123-54-6 acetylacetone 
• 100596-16-5 3-(1,3-dithian-2-yl)-pentane-2,4-dione 
• 201008-69-7 3,5-dimethyl-4-(1,3-dithian-2-yl)-isoxazole 
• 19788-36-4 4-hydroxymethyl-3,5-dimethylisoxazole 
• 2510-36-3 3,5-dimethyl-4-isoxazolecarboxylic acid 
• 300-87-8 3,5-dimethyl-1,2-oxazole 
• 56328-87-1 methyl 3,5-dimethylisoxazole-4-carboxylate 

Downstream Products

• 1421838-38-1 methyl 2-(4-(2-(3,5-dimethylisoxazol-4-yl)-2-hydroxyethoxy)phenyl)acetate 
• 1421838-41-6 2-(4-(2-(3,5-dimethylisoxazol-4-yl)-2-oxoethoxy)phenyl)-N-((2,4-dimethylphenyl)(phenyl)methyl)acetamide 
• 1421837-32-2 C₃₀H₃₂N₂O₄ 
• 1421838-42-7 methyl 2-(1-(3,5-dimethylisoxazol-4-yl)-2-(4-(2-(((2,4-dimethylphenyl)(phenyl)methyl)amino)-2-oxoethyl)phenoxy)ethoxy)-2-methylpropanoate 
• 1421837-91-3 C₃₄H₃₈N₂O₆ 
• 35166-20-2 1-(3,5-dimethyl-1,2-oxazol-4-yl)ethanone 
• 1421838-37-0 methyl 2-(4-(2-(3,5-dimethylisoxazol-4-yl)-2-oxoethoxy)phenyl)acetate 
• 1600563-06-1 (2,4-dichloro-3-phenylquinolin-6-yl)(3,5-dimethylisoxazol-4-yl)methanol 
• 1421949-53-2 2-(2-(hydroxy(3,5-dimethylisoxazol-4-yl)methyl)benzofuran-5-yl)-N-((2,4-dimethylphenyl)(phenyl)methyl)acetamide 
• 1421948-85-7 C₃₁H₂₈N₂O₅ 
• 19788-36-4 4-hydroxymethyl-3,5-dimethylisoxazole 

Relevant articles and documents

Method for synthesizing aromatic aldehyde through iron catalyzed oxidation allyl aromatic compound

The invention discloses a method for synthesizing aromatic aldehyde through an iron catalyzed oxidation allyl aromatic compound. According to the specific method, under the promotion effect of hydrogen silane, with air or oxygen as the oxidant, the aromatic aldehyde compound is synthesized through the iron catalyzed oxidation allyl aromatic compound, the reaction temperature is 20-150 DEG C, and the time is 0.25-60 h. The method has the advantages that a catalyst source is wide, the price is low and the environment is protected; an oxidant source is wide, the price is low and no waste is generated; the reaction conditions are mild, selectivity is high and the yield is high; a substrate source is wide and stable; a substrate functional group is high in compatibility and a substrate is widein application range; complicated small molecules are compatible and can be well converted into aldehyde. The target product separation yield can reach up to 96% under the optimized reaction conditions.

COMPOUNDS AND METHODS

The present invention relates to novel retinoid-related orphan receptor gamma (RORγ) modulators and their use in the treatment of diseases mediated by RORy.

Facile synthesis of isoxazole 4- and 5-carbaldehydes and their conversion to isoxazolyl-1,4-dihydropyridines

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