3-Bromobenzo[d]isoxazole

Base Information

• Chemical Name: 3-Bromobenzo[d]isoxazole
• CAS No.: 1263178-34-2
• Molecular Formula: C7H4BrNO
• Molecular Weight: 198.02
• European Community (EC) Number: 816-121-4
• DSSTox Substance ID: DTXSID80740093
• Wikidata: Q82686105
• Mol file: 1263178-34-2.mol

Synonyms:3-Bromobenzo[d]isoxazole;1263178-34-2;3-bromo-1,2-benzoxazole;1,2-Benzisoxazole, 3-bromo-;SCHEMBL4930668;DTXSID80740093;AKOS016002676;AS-77774;CS-0112728;D77128;EN300-139617;A889461

Chemical Property of 3-Bromobenzo[d]isoxazole

Chemical Property:

• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 196.94763
• Heavy Atom Count: 10
• Complexity: 131

Purity/Quality:

NLT 98% ^*data from raw suppliers

3-bromo-1,2-benzoxazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=NO2)Br