3-(Bromomethyl)-5-fluorobenzo[d]isoxazole

Base Information

• Chemical Name: 3-(Bromomethyl)-5-fluorobenzo[d]isoxazole
• CAS No.: 63167-28-2
• Molecular Formula: C₈H₅BrFNO
• Molecular Weight: 230.036
• DSSTox Substance ID: DTXSID60561849
• Wikidata: Q82445746

Synonyms:63167-28-2;3-(bromomethyl)-5-fluorobenzo[d]isoxazole;3-(Bromomethyl)-5-fluoro-1,2-benzoxazole;SCHEMBL9688702;DTXSID60561849;AKOS026713617;F1967-2413

Chemical Property of 3-(Bromomethyl)-5-fluorobenzo[d]isoxazole

Chemical Property:

• PSA: 26.03000
• LogP: 2.86180
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 228.95385
• Heavy Atom Count: 12
• Complexity: 169

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1F)C(=NO2)CBr

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