Cas no 159092-71-4 (Phenanthrene,2,10-dinitro-)

Phenanthrene,2,10-dinitro- structure
Phenanthrene,2,10-dinitro- structure
Product Name:Phenanthrene,2,10-dinitro-
CAS No:159092-71-4
MF:C14H8N2O4
MW:268.224323272705
CID:194499
PubChem ID:154724
Update Time:2025-04-19

Phenanthrene,2,10-dinitro- Chemical and Physical Properties

Names and Identifiers

    • Phenanthrene,2,10-dinitro-
    • 2,10-Dinitrophenanthrene
    • AC1L4CUO
    • AG-E-08400
    • CCRIS 7653
    • CTK4C9948
    • LS-102644
    • 159092-71-4
    • DTXSID20166571
    • Phenanthrene, 2,10-dinitro-
    • Inchi: 1S/C14H8N2O4/c17-15(18)10-5-6-12-11-4-2-1-3-9(11)7-14(16(19)20)13(12)8-10/h1-8H
    • InChI Key: GREJVCGMAWZPOA-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1C=C2C=CC=CC2=C2C=CC(=CC2=1)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 268.04844
  • Monoisotopic Mass: 268.048
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 0
  • Complexity: 403
  • 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: 4.1
  • Topological Polar Surface Area: 91.6?2

Experimental Properties

  • Density: 1.1674 (rough estimate)
  • Boiling Point: 421.12°C (rough estimate)
  • Flash Point: 254.9°C
  • Refractive Index: 1.5500 (estimate)
  • PSA: 86.28
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