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40834-88-6

40834-88-6 structural image
Product Name: 2H-Cyclopenta[b]furan-2-one, 5-(benzoyloxy)hexahydro-4-[(1E,3S)-3-hydroxy-1-octenyl]-, (3aR,4R,5R,6aS)-
Formula: C22H28O5
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COMPUTED DESCRIPTORS

Molecular Weight 372.5 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 9
Exact Mass 372.19367399 g/mol
Monoisotopic Mass 372.19367399 g/mol
Topological Polar Surface Area 72.8 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 537
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes