Cas no 887114-51-4 (1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro-)

1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro- structure
887114-51-4 structure
Product Name:1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro-
CAS No:887114-51-4
MF:C14H10FN3O2
MW:271.246506214142
MDL:MFCD09909403
CID:712947
PubChem ID:53422151
Update Time:2025-04-19

1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro- Chemical and Physical Properties

Names and Identifiers

    • 1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro-
    • 1-(4-Fluorobenzyl)-5-nitro-1H-indazole
    • 1-[(4-fluorophenyl)methyl]-5-nitroindazole
    • 1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro
    • AB3766
    • SCHEMBL5435879
    • 1-[(4-Fluorophenyl)methyl]-5-nitro-1H-indazole
    • 887114-51-4
    • MFCD09909403
    • DTXSID50697984
    • MDL: MFCD09909403
    • Inchi: 1S/C14H10FN3O2/c15-12-3-1-10(2-4-12)9-17-14-6-5-13(18(19)20)7-11(14)8-16-17/h1-8H,9H2
    • InChI Key: XZTQOLZBKIYIQF-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)CN1C2C=CC(=CC=2C=N1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 271.07600
  • Monoisotopic Mass: 271.076
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 355
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 63.6A^2
  • XLogP3: 3.1

Experimental Properties

  • PSA: 63.64000
  • LogP: 3.65510

1H-Indazole,1-[(4-fluorophenyl)methyl]-5-nitro- Pricemore >>

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