Cas no 623940-58-9 (3-(4-BROMO-2-ISOPROPYLPHENYL)SYDNONE)

3-(4-BROMO-2-ISOPROPYLPHENYL)SYDNONE structure
623940-58-9 structure
Product Name:3-(4-BROMO-2-ISOPROPYLPHENYL)SYDNONE
CAS No:623940-58-9
MF:C11H11BrN2O2
MW:283.121241807938
CID:6870997
PubChem ID:3535919
Update Time:2025-04-29

3-(4-BROMO-2-ISOPROPYLPHENYL)SYDNONE Chemical and Physical Properties

Names and Identifiers

    • 3-(4-Bromo-2-isopropylphenyl)-1,2,3-oxadiazol-3-ium-5-olate
    • AKOS024416386
    • 3-(4-BROMO-2-ISOPROPYLPHENYL)SYDNONE
    • 623940-58-9
    • Inchi: 1S/C11H11BrN2O2/c1-7(2)9-5-8(12)3-4-10(9)14-6-11(15)16-13-14/h3-7H,1-2H3
    • InChI Key: TVQKZLSQJFSLJF-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=C(C=1)C(C)C)[N+]1C=C([O-])ON=1

Computed Properties

  • Exact Mass: 282.00039Da
  • Monoisotopic Mass: 282.00039Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 240
  • 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: 4.6
  • Topological Polar Surface Area: 53?2
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