Cas no 39977-95-2 (Quinoline,7-methoxy-3-nitro-)

Quinoline,7-methoxy-3-nitro- structure
Quinoline,7-methoxy-3-nitro- structure
Product Name:Quinoline,7-methoxy-3-nitro-
CAS No:39977-95-2
MF:C10H8N2O3
MW:204.18212223053
CID:298648
PubChem ID:609280
Update Time:2025-04-19

Quinoline,7-methoxy-3-nitro- Chemical and Physical Properties

Names and Identifiers

    • Quinoline,7-methoxy-3-nitro-
    • 7-methoxy-3-nitroquinoline
    • SCHEMBL2812139
    • 39977-95-2
    • A824832
    • 7-methoxy-3-nitroquino-line
    • 7-methoxy-3-nitro-quinoline
    • DTXSID10346062
    • EU-0000349
    • CS-0367472
    • AKOS001591697
    • Inchi: 1S/C10H8N2O3/c1-15-9-3-2-7-4-8(12(13)14)6-11-10(7)5-9/h2-6H,1H3
    • InChI Key: HVGPUJMRYVXJMW-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC2=CC(=CN=C2C=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 204.05354
  • Monoisotopic Mass: 204.053492
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 241
  • 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: 1.9
  • Topological Polar Surface Area: 67.9

Experimental Properties

  • Density: 1.337
  • Boiling Point: 356.6°Cat760mmHg
  • Flash Point: 169.5°C
  • Refractive Index: 1.646
  • PSA: 65.26
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