3'-hydroxy-6'-(4-hydroxyphenoxy)spiro[2-benzofuran-3,9'-xanthene]-1-one


Chemical Name: 3'-hydroxy-6'-(4-hydroxyphenoxy)spiro[2-benzofuran-3,9'-xanthene]-1-one
CAS Number: 359010-69-8
Product Number: AG00CNJ7(AGN-PC-015JV8)
Synonyms:
MDL No:
Molecular Formula: C26H16O6
Molecular Weight: 424.4016

Identification/Properties


Computed Properties
Molecular Weight:
424.408g/mol
XLogP3:
5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
424.095g/mol
Monoisotopic Mass:
424.095g/mol
Topological Polar Surface Area:
85.2A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
704
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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