Cas no 402914-15-2 (5-BROMO-3-PHENYLBENZO[D]ISOXAZOLE)

5-BROMO-3-PHENYLBENZO[D]ISOXAZOLE structure
402914-15-2 structure
Product Name:5-BROMO-3-PHENYLBENZO[D]ISOXAZOLE
CAS No:402914-15-2
MF:C13H8BrNO
MW:274.112722396851
MDL:MFCD25542160
CID:2102307
PubChem ID:71295257
Update Time:2025-04-21

5-BROMO-3-PHENYLBENZO[D]ISOXAZOLE Chemical and Physical Properties

Names and Identifiers

    • 5-BROMO-3-PHENYLBENZO[D]ISOXAZOLE
    • 5-Bromo-3-phenyl-1,2-benzisoxazole
    • SCHEMBL14764342
    • ZYDWHXNSRCABGV-UHFFFAOYSA-N
    • 402914-15-2
    • DB-413705
    • MDL： MFCD25542160
    • Inchi： 1S/C13H8BrNO/c14-10-6-7-12-11(8-10)13(15-16-12)9-4-2-1-3-5-9/h1-8H
    • InChI Key： ZYDWHXNSRCABGV-UHFFFAOYSA-N
    • SMILES： BrC1C=CC2=C(C=1)C(C1C=CC=CC=1)=NO2

Computed Properties

  • Exact Mass: 272.97893Da
  • Monoisotopic Mass: 272.97893Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 242
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.1
  • Topological Polar Surface Area: 26?2

5-BROMO-3-PHENYLBENZO[D]ISOXAZOLE Pricemore >>

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