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100239-45-0

100239-45-0 structural image
Product Name: 3BETA-HYDROXYTIBOLONE
Formula: C21H30O2
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COMPUTED DESCRIPTORS

Molecular Weight 314.5 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 314.224580195 g/mol
Monoisotopic Mass 314.224580195 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 596
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes