Cas no 13169-72-7 (Methanone, (2-fluorophenyl)-1H-pyrrol-2-yl-)

Methanone, (2-fluorophenyl)-1H-pyrrol-2-yl- structure
13169-72-7 structure
Product Name:Methanone, (2-fluorophenyl)-1H-pyrrol-2-yl-
CAS No:13169-72-7
MF:C11H8FNO
MW:189.185726165771
CID:1228771
Update Time:2024-08-03

Methanone, (2-fluorophenyl)-1H-pyrrol-2-yl- Chemical and Physical Properties

Names and Identifiers

    • Methanone, (2-fluorophenyl)-1H-pyrrol-2-yl-
    • Inchi: 1S/C11H8FNO/c12-9-5-2-1-4-8(9)11(14)10-6-3-7-13-10/h1-7,13H
    • InChI Key: NZXZFPMSNLMAKD-UHFFFAOYSA-N
    • SMILES: C(C1=CC=CC=C1F)(C1=CC=CN1)=O

Computed Properties

  • Exact Mass: 189.05904

Experimental Properties

  • Density: 1.260±0.06 g/cm3(Predicted)
  • Melting Point: 76 °C
  • Boiling Point: 338.3±22.0 °C(Predicted)
  • PSA: 32.86
  • pka: 14.69±0.50(Predicted)
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