Cas no 34328-55-7 (1-Propanone,1-(2,6-dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl-)

1-Propanone,1-(2,6-dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl- structure
34328-55-7 structure
Product Name:1-Propanone,1-(2,6-dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl-
CAS No:34328-55-7
MF:C18H20O4
MW:300.349005699158
CID:322320
PubChem ID:10086169
Update Time:2025-04-19

1-Propanone,1-(2,6-dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl- Chemical and Physical Properties

Names and Identifiers

    • 1-Propanone,1-(2,6-dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl-
    • Myrigalon B
    • MyrigaloneB
    • Propiophenone,2',6'-dihydroxy-4'-methoxy-3',5'-dimethyl-3-phenyl- (8CI)
    • LMPK12120490
    • CHEBI:174874
    • DTXSID101317980
    • 34328-55-7
    • 1-(2,6-Dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl-1-propanone
    • 1-(2,6-Dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenylpropan-1-one
    • Myrigalone B
    • 1-(2,6-dihydroxy-4-methoxy-3,5-dimethyl-phenyl)-3-phenyl-propan-1-one
    • Inchi: 1S/C18H20O4/c1-11-16(20)15(17(21)12(2)18(11)22-3)14(19)10-9-13-7-5-4-6-8-13/h4-8,20-21H,9-10H2,1-3H3
    • InChI Key: SGSWJLOWQDDBPP-UHFFFAOYSA-N
    • SMILES: COC1C(C)=C(O)C(C(CCC2C=CC=CC=2)=O)=C(O)C=1C

Computed Properties

  • Exact Mass: 300.1362
  • Monoisotopic Mass: 300.13615911g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 5
  • Complexity: 348
  • 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
  • Topological Polar Surface Area: 66.8?2

Experimental Properties

  • PSA: 66.76

1-Propanone,1-(2,6-dihydroxy-4-methoxy-3,5-dimethylphenyl)-3-phenyl- Related Literature

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