Cas no 5792-36-9 (2',4'-Dihydroxypropiophenone)

2',4'-Dihydroxypropiophenone structure
2',4'-Dihydroxypropiophenone structure
Product Name:2',4'-Dihydroxypropiophenone
CAS No:5792-36-9
MF:C9H10O3
MW:166.173902988434
MDL:MFCD00002280
CID:46182
PubChem ID:87569105
Update Time:2025-04-18

2',4'-Dihydroxypropiophenone Chemical and Physical Properties

Names and Identifiers

    • 2',4'-dihydroxypropiophenone
    • 1-(2,4-dihydroxyphenyl)propan-1-one
    • 2,4-Dihydroxyphenyl Ethyl Ketone
    • 4-Propionylresorcinol
    • Propiophenone,2',4'-dihydroxy- (6CI,7CI,8CI)
    • 1-(2,4-Dihydroxyphenyl)-1-propanone
    • NSC 34096
    • Resopropiophenone
    • Respropiophenone
    • 2,4-Dihydroxypropiophenone
    • LLBBBYLDTDJMNU-UHFFFAOYSA-N
    • 1-Propanone, 1-(2,4-dihydroxyphenyl)-
    • 1-(2,4-Dihydroxy-Phenyl)-Propan-1-One
    • NSC34096
    • resorcinol fragment, 9
    • 2',4'-dihydroxy-propiophenone
    • 2\\',4\\'-Dihydroxypropiophenone
    • BDBM33221
    • 2,4-Dihydroxyphenyl Ethy
    • 2',4'-Dihydroxypropiophenone
    • MDL: MFCD00002280
    • Inchi: 1S/C9H10O3/c1-2-8(11)7-4-3-6(10)5-9(7)12/h3-5,10,12H,2H2,1H3
    • InChI Key: LLBBBYLDTDJMNU-UHFFFAOYSA-N
    • SMILES: CCC(C1C(O)=CC(O)=CC=1)=O
    • BRN: 1238635

Computed Properties

  • Exact Mass: 166.06300
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 167
  • 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
  • Surface Charge: 0
  • Tautomer Count: 21
  • XLogP3: 2.2
  • Topological Polar Surface Area: 57.5

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.1708 (rough estimate)
  • Melting Point: 99.0 to 102.0 deg-C
  • Boiling Point: 178°C/7mmHg(lit.)
  • Refractive Index: 1.5260 (estimate)
  • PSA: 57.53000
  • LogP: 1.69050
  • Solubility: Not determined

2',4'-Dihydroxypropiophenone Security Information

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