Cas no 24400-66-6 (Naphth[1,2-c]isoxazole, 3-phenyl-)

Naphth[1,2-c]isoxazole, 3-phenyl- structure
24400-66-6 structure
Product Name:Naphth[1,2-c]isoxazole, 3-phenyl-
CAS No:24400-66-6
MF:C17H11NO
MW:245.275344133377
CID:1418478
Update Time:2024-08-15

Naphth[1,2-c]isoxazole, 3-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Naphth[1,2-c]isoxazole, 3-phenyl-
    • Inchi: 1S/C17H11NO/c1-2-7-13(8-3-1)17-15-11-10-12-6-4-5-9-14(12)16(15)18-19-17/h1-11H
    • InChI Key: TXTUGXCKDSYUMM-UHFFFAOYSA-N
    • SMILES: O1C(C2=CC=CC=C2)=C2C=CC3=C(C2=N1)C=CC=C3

Computed Properties

  • Exact Mass: 245.08413

Experimental Properties

  • Density: 1.232±0.06 g/cm3(Predicted)
  • Boiling Point: 460.8±14.0 °C(Predicted)
  • PSA: 26.03
  • pka: -3.02±0.30(Predicted)
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