Cas no 160657-11-4 (Pyridine,6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)-)

Pyridine,6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)- structure
160657-11-4 structure
Product Name:Pyridine,6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)-
CAS No:160657-11-4
MF:C10H9N3O3
MW:219.196761846542
CID:98414
PubChem ID:10560813
Update Time:2025-04-18

Pyridine,6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)- Chemical and Physical Properties

Names and Identifiers

    • Pyridine,6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)-
    • 6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)-Pyridine
    • 6-methoxy-3-nitro-2-pyrrol-1-ylpyridine
    • 6-methoxy-3-nitro-2-(1-pyrrolyl)pyridine
    • DTXSID80441755
    • 6-methoxy-3-nitro-2-(1H-pyrrol-1-yl)pyridine
    • 160657-11-4
    • SCHEMBL8569551
    • NRBHEFUHIDJZOH-UHFFFAOYSA-N
    • Inchi: 1S/C10H9N3O3/c1-16-9-5-4-8(13(14)15)10(11-9)12-6-2-3-7-12/h2-7H,1H3
    • InChI Key: NRBHEFUHIDJZOH-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC=C(C(=N1)N1C=CC=C1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 219.06447
  • Monoisotopic Mass: 219.06439116g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 250
  • 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: 1.7
  • Topological Polar Surface Area: 72.9?2

Experimental Properties

  • Density: 1.344
  • Boiling Point: 388.193°C at 760 mmHg
  • Flash Point: 188.573°C
  • Refractive Index: 1.622
  • PSA: 70.19
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