3-Bromoisoxazolo[5,4-b]pyridine

Base Information

• Chemical Name: 3-Bromoisoxazolo[5,4-b]pyridine
• CAS No.: 864872-31-1
• Molecular Formula: C6H3BrN2O
• Molecular Weight: 199.01
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID30373133
• Wikidata: Q82161312
• Mol file: 864872-31-1.mol

Synonyms:3-bromoisoxazolo[5,4-b]pyridine;864872-31-1;3-bromo-[1,2]oxazolo[5,4-b]pyridine;DTXSID30373133;AKOS004902775;3-Bromoisoxazolo[5,4-b]pyridine 95+%;AS-60523;CS-0186794;A863155

Chemical Property of 3-Bromoisoxazolo[5,4-b]pyridine

Chemical Property:

• Vapor Pressure: 0.00281mmHg at 25°C
• Refractive Index: 1.66
• Boiling Point: 294.698 °C at 760 mmHg
• PKA: 0.13±0.50(Predicted)
• Flash Point: 132.029 °C
• PSA: 38.92000
• Density: 1.826 g/cm³
• LogP: 1.98530
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 197.94288
• Heavy Atom Count: 10
• Complexity: 133

Purity/Quality:

99% ^*data from raw suppliers

3-Bromoisoxazolo[5,4-b]pyridine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(N=C1)ON=C2Br