Cas no 33045-42-0 (1H-Pyrazole, 3-(4-chlorophenyl)-1-phenyl-5-(2-thienyl)-)

1H-Pyrazole, 3-(4-chlorophenyl)-1-phenyl-5-(2-thienyl)- structure
33045-42-0 structure
Product Name:1H-Pyrazole, 3-(4-chlorophenyl)-1-phenyl-5-(2-thienyl)-
CAS No:33045-42-0
MF:C19H13ClN2S
MW:336.837921857834
CID:1454525
Update Time:2024-08-23

1H-Pyrazole, 3-(4-chlorophenyl)-1-phenyl-5-(2-thienyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole, 3-(4-chlorophenyl)-1-phenyl-5-(2-thienyl)-
    • Inchi: 1S/C19H13ClN2S/c20-15-10-8-14(9-11-15)17-13-18(19-7-4-12-23-19)22(21-17)16-5-2-1-3-6-16/h1-13H
    • InChI Key: YDLIWKIMMUIQOV-UHFFFAOYSA-N
    • SMILES: N1(C2=CC=CC=C2)C(C2SC=CC=2)=CC(C2=CC=C(Cl)C=C2)=N1

Computed Properties

  • Exact Mass: 336.04899

Experimental Properties

  • Density: 1.27±0.1 g/cm3(Predicted)
  • Melting Point: 128-129 °C
  • Boiling Point: 498.9±35.0 °C(Predicted)
  • PSA: 17.82
  • pka: -1.09±0.10(Predicted)
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