Cas no 2643-85-8 (Oxypeucedanin hydrate)

Oxypeucedanin hydrate structure
Oxypeucedanin hydrate structure
Product Name:Oxypeucedanin hydrate
CAS No:2643-85-8
MF:C16H16O6
MW:304.294645309448
CID:260394
PubChem ID:17536
Update Time:2025-04-19

Oxypeucedanin hydrate Chemical and Physical Properties

Names and Identifiers

    • Oxypeucedanin hydrate
    • 7H-Furo[3,2-g][1]benzopyran-7-one,4-(2,3-dihydroxy-3-methylbutoxy)-,(R)-
    • 7H-Furo[3,2-g][1]benzopyran-7-one,4-[(2R)-2,3-dihydroxy-3-methylbutoxy]-
    • OXYPEUCEDANIN HYDRATE(P)
    • Oxypeucedaninhydrate
    • Prangolarin hydrate
    • (+)-Oxypeucedanin hydrate
    • Prawgol
    • Hydroxypeucedanin hydrate
    • (R)-oxypeucedanin hydrate
    • 7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2,3-dihydroxy-3-methylbutoxy)-, (R)-
    • 7H-FURO(3,2-g)(1)BENZOPYRAN-7-ONE, 4-(2,3-DIHYDROXY-3-METHYLBUTOXY)-, (R)-(+)-
    • Aviprin
    • MLS000574909
    • Aviprin (Oxypeucedaninhydrate)
    • HMS2196F22
    • BDBM50361377
    • SMR000156244
    • 1ST164211
    • CHEBI:69829
    • AKOS000278024
    • 4-[(2R)-2,3-dihydroxy-3-methyl-butoxy]furo[3,2-g]chromen-7-one
    • 2643-85-8
    • NS00094521
    • MS-24390
    • (+)-Oxypeucedaninhydrate
    • CHEMBL454060
    • HY-N2622
    • DTXSID90949318
    • 7H-Furo[3,2-g][1]benzopyran-7-one, 4-[(2R)-2,3-dihydroxy-3-methylbutoxy]-
    • 4-[(2R)-2,3-dihydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one
    • Q27138170
    • CS-0023028
    • Prangol
    • (R)-(+)-Oxypeucedanin Hydrate
    • Dihydroxypeucedanin
    • ConMedNP.1785
    • ConMedNP.1784
    • SMR000440613
    • MLSMR
    • MLS000877013
    • (+)-Aviprin
    • DA-56521
    • MDL: MFCD01725702
    • Inchi: 1S/C16H16O6/c1-16(2,19)13(17)8-21-15-9-3-4-14(18)22-12(9)7-11-10(15)5-6-20-11/h3-7,13,17,19H,8H2,1-2H3/t13-/m1/s1
    • InChI Key: PEWFWDOPJISUOK-CYBMUJFWSA-N
    • SMILES: O(C1=C2C=CC(=O)OC2=CC2=C1C=CO2)C[C@H](C(C)(C)O)O

Computed Properties

  • Exact Mass: 304.09500
  • Monoisotopic Mass: 304.094688
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 460
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 89.1
  • Molecular Weight: 304.29
  • XLogP3: 1.6

Experimental Properties

  • Color/Form: Cryst.
  • Density: 1.386±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 187-188 oC
  • Boiling Point: 544.3°C at 760 mmHg
  • Flash Point: 283°C
  • Refractive Index: 1.63
  • Solubility: Very slightly soluble (0.24 g/l) (25 o C),
  • PSA: 93.04000
  • LogP: 2.04980

Oxypeucedanin hydrate Pricemore >>

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