Cas no 121361-55-5 (Ethanone,1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)-)

Ethanone,1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)- structure
121361-55-5 structure
Product Name:Ethanone,1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)-
CAS No:121361-55-5
MF:C15H14O5
MW:274.268664836884
CID:185326
PubChem ID:729354
Update Time:2025-04-19

Ethanone,1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)- Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)-
    • 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)ethanone
    • 1-(2,4-Dihydroxyphenyl)-2-(4-methoxyphenoxy)ethanone, AldrichCPR
    • CHEMBL4457123
    • Oprea1_699661
    • DTXSID60153248
    • BDBM223296
    • Sm11
    • Oprea1_032270
    • 1-(2,4-DIHYDROXYPHENYL)-2-(4-METHOXYPHENOXY)-1-ETHANONE
    • 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)ethan-1-one
    • Ethanone, 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)-
    • 121361-55-5
    • BRN 5438871
    • MFCD00518537
    • SCHEMBL3719175
    • AKOS000272785
    • Inchi: 1S/C15H14O5/c1-19-11-3-5-12(6-4-11)20-9-15(18)13-7-2-10(16)8-14(13)17/h2-8,16-17H,9H2,1H3
    • InChI Key: GJESQJQIJJOFBG-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=CC=1)OC)CC(C1C=CC(=CC=1O)O)=O

Computed Properties

  • Exact Mass: 274.08412
  • Monoisotopic Mass: 274.084124
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 5
  • Complexity: 311
  • 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: 3.3
  • Topological Polar Surface Area: 76

Experimental Properties

  • Density: 1.304
  • Boiling Point: 506.7°C at 760 mmHg
  • Flash Point: 193°C
  • Refractive Index: 1.61
  • PSA: 75.99
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