Cas no 101581-15-1 (3-Cinnolinamine, 6-chloro-)

3-Cinnolinamine, 6-chloro- structure
3-Cinnolinamine, 6-chloro- structure
Product Name:3-Cinnolinamine, 6-chloro-
CAS No:101581-15-1
MF:C8H6ClN3
MW:179.606339931488
CID:1132661
Update Time:2024-07-27

3-Cinnolinamine, 6-chloro- Chemical and Physical Properties

Names and Identifiers

    • 3-Cinnolinamine, 6-chloro-
    • Inchi: 1S/C8H6ClN3/c9-6-1-2-7-5(3-6)4-8(10)12-11-7/h1-4H,(H2,10,12)
    • InChI Key: QFLOQNXVGYPQLL-UHFFFAOYSA-N
    • SMILES: N1=C2C(C=C(Cl)C=C2)=CC(N)=N1

Computed Properties

  • Exact Mass: 179.02518

Experimental Properties

  • Density: 1.445±0.06 g/cm3(Predicted)
  • Boiling Point: 393.1±45.0 °C(Predicted)
  • PSA: 51.8
  • pka: 3.09±0.10(Predicted)
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