Cas no 13459-12-6 (4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)-)

4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)- structure
13459-12-6 structure
Product Name:4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)-
CAS No:13459-12-6
MF:C22H16O7
MW:392.358246803284
CID:1243235
Update Time:2024-08-05

4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)- Chemical and Physical Properties

Names and Identifiers

    • 4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)-
    • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)-
    • Inchi： 1S/C22H16O7/c23-15-7-6-13(8-16(15)24)22-21(27)20(26)19-17(25)9-14(10-18(19)29-22)28-11-12-4-2-1-3-5-12/h1-10,23-25,27H,11H2
    • InChI Key： SCJDVAUETMOZCA-UHFFFAOYSA-N
    • SMILES： C1(C2=CC=C(O)C(O)=C2)OC2=CC(OCC3=CC=CC=C3)=CC(O)=C2C(=O)C=1O

Computed Properties

  • Exact Mass: 392.08958

Experimental Properties

  • Density: 1.543±0.06 g/cm3(Predicted)
  • Melting Point: 245-246 °C
  • Boiling Point: 692.5±55.0 °C(Predicted)
  • PSA: 116.45
  • pka: 6.15±0.40(Predicted)

4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(phenylmethoxy)- Related Literature

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