Cas no 72617-83-5 (2-(1,1-Dimethylethoxy)-5-nitropyridine)

2-(1,1-Dimethylethoxy)-5-nitropyridine structure
72617-83-5 structure
Product Name:2-(1,1-Dimethylethoxy)-5-nitropyridine
CAS No:72617-83-5
MF:C9H12N2O3
MW:196.203182220459
CID:977386
PubChem ID:14657263
Update Time:2025-04-19

2-(1,1-Dimethylethoxy)-5-nitropyridine Chemical and Physical Properties

Names and Identifiers

    • 2-(1,1-Dimethylethoxy)-5-nitropyridine
    • 2-[(2-methylpropan-2-yl)oxy]-5-nitropyridine
    • 2-tert-butoxy-5-nitropyridine
    • Pyridine, 2-(1,1-dimethylethoxy)-5-nitro- (9CI)
    • 2-t-butoxy-5-nitropyridine
    • SCHEMBL11549503
    • DTXSID60562674
    • Pyridine,2-(1,1-dimethylethoxy)-5-nitro-(9ci)
    • 72617-83-5
    • GFVZPYNNDUUGJP-UHFFFAOYSA-N
    • 2-(TERT-BUTOXY)-5-NITROPYRIDINE
    • DB-391834
    • MDL: MFCD11848724
    • Inchi: 1S/C9H12N2O3/c1-9(2,3)14-8-5-4-7(6-10-8)11(12)13/h4-6H,1-3H3
    • InChI Key: GFVZPYNNDUUGJP-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=CN=1)[N+](=O)[O-])C(C)(C)C

Computed Properties

  • Exact Mass: 196.08479225g/mol
  • Monoisotopic Mass: 196.08479225g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 207
  • 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: 2.5
  • Topological Polar Surface Area: 67.9?2
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