Cas no 63987-04-2 (5-Hydroxynitrofen)

5-Hydroxynitrofen structure
5-Hydroxynitrofen structure
Product Name:5-Hydroxynitrofen
CAS No:63987-04-2
MF:C12H7Cl2NO4
MW:300.094281435013
CID:425196
PubChem ID:14591739
Update Time:2025-04-19

5-Hydroxynitrofen Chemical and Physical Properties

Names and Identifiers

    • Phenol, 2,4-dichloro-5-(4-nitrophenoxy)-
    • 5-Hydroxynitrofen
    • 2,4-dichloro-5-(4-nitrophenoxy)phenol
    • AKOS030255441
    • DTXSID20561961
    • 63987-04-2
    • 5-hydroxy-2,4-dichloro-4'-nitrodiphenyl ether
    • Inchi: 1S/C12H7Cl2NO4/c13-9-5-10(14)12(6-11(9)16)19-8-3-1-7(2-4-8)15(17)18/h1-6,16H
    • InChI Key: WDVAZDOELNWYFI-UHFFFAOYSA-N
    • SMILES: ClC1=CC(=C(C=C1OC1C=CC(=CC=1)[N+](=O)[O-])O)Cl

Computed Properties

  • Exact Mass: 298.97531
  • Monoisotopic Mass: 298.9752131g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 317
  • 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: 4.2
  • Topological Polar Surface Area: 75.3?2

Experimental Properties

  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 399.4±42.0 °C at 760 mmHg
  • Flash Point: 195.4±27.9 °C
  • Solubility: Ethyl Acetate, Methanol, DCM
  • PSA: 72.6
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

5-Hydroxynitrofen Security Information

5-Hydroxynitrofen Pricemore >>

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