Cas no 58904-47-5 (4H-1-Benzopyran-4-one,3,5,7,8-tetrahydroxy-2-(3-hydroxy-4-methoxyphenyl)-)

4H-1-Benzopyran-4-one,3,5,7,8-tetrahydroxy-2-(3-hydroxy-4-methoxyphenyl)- structure
58904-47-5 structure
Product Name:4H-1-Benzopyran-4-one,3,5,7,8-tetrahydroxy-2-(3-hydroxy-4-methoxyphenyl)-
CAS No:58904-47-5
MF:C16H12O8
MW:332.261685371399
CID:340469
Update Time:2024-03-01

4H-1-Benzopyran-4-one,3,5,7,8-tetrahydroxy-2-(3-hydroxy-4-methoxyphenyl)- Chemical and Physical Properties

Names and Identifiers

    • 4H-1-Benzopyran-4-one,3,5,7,8-tetrahydroxy-2-(3-hydroxy-4-methoxyphenyl)-
    • 4H-1-Benzopyran-4-one, 3,5,7,8-tetrahydroxy-2-(3-hydroxy-4-methoxyphenyl)-
    • Inchi： 1S/C16H12O8/c1-23-10-3-2-6(4-7(10)17)15-14(22)13(21)11-8(18)5-9(19)12(20)16(11)24-15/h2-5,17-20,22H,1H3
    • InChI Key： APDVUIGQEYFRET-UHFFFAOYSA-N
    • SMILES： C1(C2=CC=C(OC)C(O)=C2)OC2=C(O)C(O)=CC(O)=C2C(=O)C=1O

Computed Properties

  • Exact Mass: 332.05316

Experimental Properties

  • Density: 1.730±0.06 g/cm3(Predicted)
  • Boiling Point: 636.2±55.0 °C(Predicted)
  • PSA: 136.68
  • pka: 6.47±0.40(Predicted)

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