Cas no 32110-66-0 (Quinoline, 4,8-dinitro-)

Quinoline, 4,8-dinitro- structure
Quinoline, 4,8-dinitro- structure
Product Name:Quinoline, 4,8-dinitro-
CAS No:32110-66-0
MF:C9H5N3O4
MW:219.153701543808
CID:322106
PubChem ID:190304
Update Time:2025-04-19

Quinoline, 4,8-dinitro- Chemical and Physical Properties

Names and Identifiers

    • Quinoline, 4,8-dinitro-
    • 4,8-dinitroquinoline
    • DTXSID70185898
    • 8-nitro-4-nitroquinoline
    • 32110-66-0
    • Inchi： 1S/C9H5N3O4/c13-11(14)7-4-5-10-9-6(7)2-1-3-8(9)12(15)16/h1-5H
    • InChI Key： IYEBZWRBENQZLA-UHFFFAOYSA-N
    • SMILES： [O-][N+](C1C=CN=C2C(=CC=CC2=1)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 219.02805
  • Monoisotopic Mass: 219.02800565g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 298
  • 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: 1.8
  • Topological Polar Surface Area: 105?2

Experimental Properties

  • PSA: 99.17

Quinoline, 4,8-dinitro- Related Literature

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