Cas no 1823-00-3 (1,2,4-Oxadiazole, 3-(phenylmethyl)-5-(trichloromethyl)-)

1,2,4-Oxadiazole, 3-(phenylmethyl)-5-(trichloromethyl)- structure
1823-00-3 structure
Product Name:1,2,4-Oxadiazole, 3-(phenylmethyl)-5-(trichloromethyl)-
CAS No:1823-00-3
MF:C10H7Cl3N2O
MW:277.534379243851
CID:1373884
Update Time:2024-08-14

1,2,4-Oxadiazole, 3-(phenylmethyl)-5-(trichloromethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1,2,4-Oxadiazole, 3-(phenylmethyl)-5-(trichloromethyl)-
    • Inchi: 1S/C10H7Cl3N2O/c11-10(12,13)9-14-8(15-16-9)6-7-4-2-1-3-5-7/h1-5H,6H2
    • InChI Key: HZYYPAZDJHOJTH-UHFFFAOYSA-N
    • SMILES: O1C(C(Cl)(Cl)Cl)=NC(CC2=CC=CC=C2)=N1

Computed Properties

  • Exact Mass: 275.96261

Experimental Properties

  • Density: 1.465±0.06 g/cm3(Predicted)
  • Boiling Point: 341.3±52.0 °C(Predicted)
  • PSA: 38.92
  • pka: -4.24±0.48(Predicted)
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