Cas no 1158680-87-5 (1-(7-Bromo-1H-indazol-1-yl)ethanone)

1-(7-Bromo-1H-indazol-1-yl)ethanone structure
1158680-87-5 structure
Product Name:1-(7-Bromo-1H-indazol-1-yl)ethanone
CAS No:1158680-87-5
MF:C9H7BrN2O
MW:239.068681001663
MDL:MFCD25460308
CID:1204966
PubChem ID:74788284
Update Time:2025-04-20

1-(7-Bromo-1H-indazol-1-yl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(7-Bromo-1H-indazol-1-yl)ethanone
    • Ethanone, 1-(7-bromo-1H-indazol-1-yl)-
    • 1-(7-Bromo-1H-indazol-1-yl)ethan-1-one
    • 1-(7-BROMOINDAZOL-1-YL)ETHANONE
    • CS-0451929
    • A893794
    • F18620
    • 1158680-87-5
    • MDL: MFCD25460308
    • Inchi: 1S/C9H7BrN2O/c1-6(13)12-9-7(5-11-12)3-2-4-8(9)10/h2-5H,1H3
    • InChI Key: OERWCDJFJQROCH-UHFFFAOYSA-N
    • SMILES: BrC1=CC=CC2C=NN(C(C)=O)C=21

Computed Properties

  • Exact Mass: 237.97421
  • Monoisotopic Mass: 237.97418g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 222
  • 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: 2.1
  • Topological Polar Surface Area: 34.9?2

Experimental Properties

  • PSA: 34.89

1-(7-Bromo-1H-indazol-1-yl)ethanone Pricemore >>

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