3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one


Chemical Name: 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one
CAS Number: 28610-31-3
Product Number: AG002VUX(AGN-PC-0LPZ8C)
Synonyms:
MDL No:
Molecular Formula: C20H18O6
Molecular Weight: 354.3533

Identification/Properties


Computed Properties
Molecular Weight:
354.358g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
354.11g/mol
Monoisotopic Mass:
354.11g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
597
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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