Cas no 709046-13-9 (1-(6-fluoro-1H-indazol-1-yl)-Ethanone)

1-(6-fluoro-1H-indazol-1-yl)-Ethanone structure
709046-13-9 structure
Product Name:1-(6-fluoro-1H-indazol-1-yl)-Ethanone
CAS No:709046-13-9
MF:C9H7FN2O
MW:178.163085222244
CID:1116398
PubChem ID:76852744
Update Time:2025-04-20

1-(6-fluoro-1H-indazol-1-yl)-Ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(6-fluoro-1H-indazol-1-yl)-Ethanone
    • 1-(6-Fluoro-1H-indazol-1-yl)ethan-1-one
    • 1-(6-FLUOROINDAZOL-1-YL)ETHANONE
    • 709046-13-9
    • 1-(6-Fluoro-1H-indazol-1-yl)ethanone
    • DB-345367
    • Inchi: 1S/C9H7FN2O/c1-6(13)12-9-4-8(10)3-2-7(9)5-11-12/h2-5H,1H3
    • InChI Key: XDJNPIATRJVLPY-UHFFFAOYSA-N
    • SMILES: FC1C=CC2C=NN(C(C)=O)C=2C=1

Computed Properties

  • Exact Mass: 178.05400
  • Monoisotopic Mass: 178.05424101g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • 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: 1.6
  • Topological Polar Surface Area: 34.9?2

Experimental Properties

  • PSA: 34.89000
  • LogP: 1.83550
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