175205-62-6

Basic information

• Product Name: 3-(CHLOROMETHYL)-5-(3-METHOXYPHENYL)-1,2,4-OXADIAZOLE
• Synonyms: BUTTPARK 48\08-24;3-(CHLOROMETHYL)-5-(3-METHOXYPHENYL)-1,2,4-OXADIAZOLE;3-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]anisole, 3-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenyl methyl ether
• CAS NO: 175205-62-6
• Molecular Formula: C₁₀H₉ClN₂O₂
• Molecular Weight: 224.64
• Mol File: 175205-62-6.mol
• Article Data: 3

Chemical Properties

• Melting Point: 58-59℃
• Boiling Point: 364.6°Cat760mmHg
• Flash Point: 174.3°C
• Appearance: /
• Density: 1.278g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.548
• CAS DataBase Reference: 3-(CHLOROMETHYL)-5-(3-METHOXYPHENYL)-1,2,4-OXADIAZOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(CHLOROMETHYL)-5-(3-METHOXYPHENYL)-1,2,4-OXADIAZOLE(175205-62-6)
• EPA Substance Registry System: 3-(CHLOROMETHYL)-5-(3-METHOXYPHENYL)-1,2,4-OXADIAZOLE(175205-62-6)

Safety Data

• Hazard Codes: C,Xn
• Statements: 22
• HazardClass: IRRITANT
• Hazardous Substances Data: 175205-62-6(Hazardous Substances Data)

Usage

General Description

3-(Chloromethyl)-5-(3-methoxyphenyl)-1,2,4-oxadiazole is a specialized chemical compound. The overarching family of oxadiazoles refers to a group of organic compounds containing a five-membered ring with two carbon atoms, two nitrogen atoms, and one oxygen atom. Within this family, the variant 3-(Chloromethyl)-5-(3-methoxyphenyl)-1,2,4-oxadiazole STANDS OUT with its specific structural components that include a chloromethyl group and a methoxyphenyl group, making it of potential interest for organic chemistry studies or other specific industrial uses. However, information about its actual applications and hazards are sparse and further research may be required for a complete understanding of this compound.

InChI:InChI=1/C10H9ClN2O2/c1-14-8-4-2-3-7(5-8)10-12-9(6-11)13-15-10/h2-5H,6H2,1H3

Upstream product

• 1711-05-3 m-anisoyl chloride 
• 255876-59-6 C₁₀H₁₁ClN₂O₃ 

Downstream Products

• 1354696-65-3 8-(3-{[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methoxy}-1-methyl-1H-pyrazol-5-yl)-1,3-dipropyl-7-{[2-(trimethylsilanyl)ethoxy]methyl}-3,7-dihydro-1H-purine-2,6-dione 
• 1354696-56-2 8-(3-{[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methoxy}-1-methyl-1H-pyrazol-5-yl)-1,3-dipropyl-3,7-dihydro-1H-purine-2,6-dione 
• 1352565-30-0 (R)-1-((5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl)methyl)-3-((R)-2-phenyl-2-(phenylamino)acetoxy)-1-azoniabicyclo[2.2.2]octane chloride 

Relevant articles and documents

Novel 1,3-dipropyl-8-(1-heteroarylmethyl-1H-pyrazol-4-yl)-xanthine derivatives as high affinity and selective A2B adenosine receptor antagonists

A series of new 1,3-dipropyl-8-(1-heteroarylmethyl-1H-pyrazol-4-yl)- xanthine derivatives as A2B-AdoR antagonists have been synthesized and evaluated for their binding affinities for the A2B, A 1, A2A, and A3-AdoRs. 8-(1-((3-phenyl-1,2,4- oxadiazol-5-yl)methyl)-1H-pyrazol-4-yl)-1,3-dipropyl-1H-purine-2,6(3H,7H)-dione (4) displayed high affinity (Ki = 1 nM) and selectivity for the A2B-AdoR versus A1, A2A, and A 3-AdoRs (A1/A2B, A2A/A2B, and A3/A2B selectivity ratios of 370, 1100, and 480, respectively). The synthesis and SAR of this novel class of compounds are presented herein.

The discovery of a selective, high affinity A2B adenosine receptor antagonist for the potential treatment of asthma

Adenosine has been suggested to play a role in asthma, possibly via activation of A2B adenosine receptors on mast cells and other pulmonary cells. We describe our initial efforts to discover a xanthine based selective A2B AdoR antagonist that resulted in the discovery of CVT-5440, a high affinity A2B AdoR antagonist with good selectivity (A2B AdoR Ki = 50 nM, selectivity A1 > 200: A2A > 200: A3 > 167).