Cas no 303188-73-0 (1H-Indazole, 1-[(4-nitrophenyl)methyl]-)

1H-Indazole, 1-[(4-nitrophenyl)methyl]- structure
303188-73-0 structure
Product Name:1H-Indazole, 1-[(4-nitrophenyl)methyl]-
CAS No:303188-73-0
MF:C14H11N3O2
MW:253.256042718887
CID:1442369
Update Time:2024-08-15

1H-Indazole, 1-[(4-nitrophenyl)methyl]- Chemical and Physical Properties

Names and Identifiers

    • 1H-Indazole, 1-[(4-nitrophenyl)methyl]-
    • Inchi: 1S/C14H11N3O2/c18-17(19)13-7-5-11(6-8-13)10-16-14-4-2-1-3-12(14)9-15-16/h1-9H,10H2
    • InChI Key: TZQPPHWWTVIWGB-UHFFFAOYSA-N
    • SMILES: N1(CC2=CC=C([N+]([O-])=O)C=C2)C2=C(C=CC=C2)C=N1

Computed Properties

  • Exact Mass: 253.08523

Experimental Properties

  • Density: 1.30±0.1 g/cm3(Predicted)
  • Melting Point: 122 °C
  • Boiling Point: 463.9±28.0 °C(Predicted)
  • PSA: 60.96
  • pka: 1.08±0.30(Predicted)
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