Cas no 14753-18-5 (Quinoline, 8-nitro-,1-oxide)

Quinoline, 8-nitro-,1-oxide structure
Quinoline, 8-nitro-,1-oxide structure
Product Name:Quinoline, 8-nitro-,1-oxide
CAS No:14753-18-5
MF:C9H6N2O3
MW:190.15554189682
CID:233305
PubChem ID:84627
Update Time:2025-04-19

Quinoline, 8-nitro-,1-oxide Chemical and Physical Properties

Names and Identifiers

    • Quinoline, 8-nitro-,1-oxide
    • 8-nitro-quinoline N-oxide
    • MUOCQTVDQHFBEA-UHFFFAOYSA-
    • Quinoline, 7-nitro-, 1-oxide
    • 7-nitroquinolin-1-ium-1-olate
    • 7-nitroquinolin-1-oxide
    • EN300-153312
    • InChI=1/C9H6N2O3/c12-10-5-1-2-7-3-4-8(11(13)14)6-9(7)10/h1-6H
    • SCHEMBL8004257
    • 14753-18-5
    • 7-Nitroquinoline N-oxide
    • AKOS022177961
    • Quinonline, 8-nitro-, 1-oxide
    • 14753-17-4
    • 7-Nitro-1-oxidoquinolin-1-ium
    • Inchi: 1S/C9H6N2O3/c12-10-5-1-2-7-3-4-8(11(13)14)6-9(7)10/h1-6H
    • InChI Key: MUOCQTVDQHFBEA-UHFFFAOYSA-N
    • SMILES: [O-][N+]1C=CC=C2C=CC(=CC=12)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 190.038
  • Monoisotopic Mass: 190.038
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 229
  • 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
  • XLogP3: 0.4
  • Topological Polar Surface Area: 71.3A^2

Experimental Properties

  • Density: 1.42
  • Boiling Point: 400.9°Cat760mmHg
  • Flash Point: 196.3°C
  • Refractive Index: 1.659
  • LogP: 2.69970

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