Cas no 53172-02-4 (3-Octanone,1-(4-hydroxy-3-methoxyphenyl)-)

3-Octanone,1-(4-hydroxy-3-methoxyphenyl)- structure
53172-02-4 structure
Product Name:3-Octanone,1-(4-hydroxy-3-methoxyphenyl)-
CAS No:53172-02-4
MF:C15H22O3
MW:250.333384990692
CID:379771
Update Time:2024-01-29

3-Octanone,1-(4-hydroxy-3-methoxyphenyl)- Chemical and Physical Properties

Names and Identifiers

    • 3-Octanone,1-(4-hydroxy-3-methoxyphenyl)-
    • [4]-Paradol
    • 3-Octanone,1-(4-hydroxy-m-anisyl)- (3CI)
    • 4-Hydroxy-3-methoxyphenethyl pentyl ketone
    • 3-Octanone, 1-(4-hydroxy-3-methoxyphenyl)-
    • Inchi: 1S/C15H22O3/c1-3-4-5-6-13(16)9-7-12-8-10-14(17)15(11-12)18-2/h8,10-11,17H,3-7,9H2,1-2H3
    • InChI Key: MBWSWCPYOSJTDU-UHFFFAOYSA-N
    • SMILES: C(C1=CC=C(O)C(OC)=C1)CC(=O)CCCCC

Computed Properties

  • Exact Mass: 250.15696

Experimental Properties

  • Density: 1.039±0.06 g/cm3(Predicted)
  • Melting Point: 38.0-38.5 °C
  • Boiling Point: 177-178 °C(Press: 3 Torr)
  • PSA: 46.53
  • pka: 10.02±0.20(Predicted)
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