4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxy-


Chemical Name: 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxy-
CAS Number: 548-77-6
Product Number: AG00DA4Z(AGN-PC-0LPKH6)
Synonyms:
MDL No:
Molecular Formula: C16H12O6
Molecular Weight: 300.2629

Identification/Properties


Computed Properties
Molecular Weight:
300.266g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
300.063g/mol
Monoisotopic Mass:
300.063g/mol
Topological Polar Surface Area:
96.2A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
454
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

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NMR Spectrum


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