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54324-79-7

54324-79-7 structural image
Product Name: [1,1'-Biphenyl]-4-carboxylic acid [3aR-[3aa,4a(E),5b,6aa]]-4-[4-(3-chlorophenoxy)-3-oxo-1-butenyl]hexahydro-2-oxo-2H-cyclopenta[b]furan-5-yl ester
Formula: C30H25ClO6
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COMPUTED DESCRIPTORS

Molecular Weight 517.0 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 9
Exact Mass 516.1339662 g/mol
Monoisotopic Mass 516.1339662 g/mol
Topological Polar Surface Area 78.9 Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 843
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes