4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-


Chemical Name: 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-
CAS Number: 529-44-2
Product Number: AG0035A3(AGN-PC-0LPKG3)
Synonyms:
MDL No:
Molecular Formula: C15H10O8
Molecular Weight: 318.2351

Identification/Properties


Properties
MP:
>300 °C(lit.);
BP:
747.6 °C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Refractive Index:
1.4395 (estimate)
Solubility:
ethanol: soluble10mg/mL, clear to very faintly turbid, yellow to very deep greenish-yellow
Computed Properties
Molecular Weight:
318.237g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
1
Exact Mass:
318.038g/mol
Monoisotopic Mass:
318.038g/mol
Topological Polar Surface Area:
148A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
506
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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