4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-methoxyphenyl)-


Chemical Name: 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-methoxyphenyl)-
CAS Number: 491-80-5
Product Number: AG00I8TZ(AGN-PC-00FZEE)
Synonyms:
MDL No:
Molecular Formula: C16H12O5
Molecular Weight: 284.2635

Identification/Properties


Computed Properties
Molecular Weight:
284.267g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
284.068g/mol
Monoisotopic Mass:
284.068g/mol
Topological Polar Surface Area:
76A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
424
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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