Cas no 856965-85-0 (4-Pyridinol,5-chloro-2-ethoxy-)

4-Pyridinol,5-chloro-2-ethoxy- structure
856965-85-0 structure
Product Name:4-Pyridinol,5-chloro-2-ethoxy-
CAS No:856965-85-0
MF:C7H8ClNO2
MW:173.596920967102
MDL:MFCD16878199
CID:717638
Update Time:2024-01-31

4-Pyridinol,5-chloro-2-ethoxy- Chemical and Physical Properties

Names and Identifiers

    • 4-Pyridinol,5-chloro-2-ethoxy-
    • 4-Pyridinol, 5-chloro-2-ethoxy-
    • 5-Chloro-2-ethoxypyridin-4-ol
    • MDL: MFCD16878199
    • Inchi: 1S/C7H8ClNO2/c1-2-11-7-3-6(10)5(8)4-9-7/h3-4H,2H2,1H3,(H,9,10)
    • InChI Key: KDUSZGVHBBTCIJ-UHFFFAOYSA-N
    • SMILES: C1(OCC)=NC=C(Cl)C(O)=C1

Computed Properties

  • Exact Mass: 173.024
  • Monoisotopic Mass: 173.024
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 233
  • 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
  • Topological Polar Surface Area: 38.3A^2

Experimental Properties

  • Density: 1.299±0.06 g/cm3(Predicted)
  • Melting Point: 201.5-202 °C
  • Boiling Point: 355.4±37.0 °C(Predicted)
  • pka: 7.97±0.10(Predicted)

4-Pyridinol,5-chloro-2-ethoxy- Pricemore >>

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