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86668-63-5

86668-63-5 structural image
Product Name: 1-ACETOXY-8-HYDROXY-1,4,4A,9A-TETRAHYDROANTHRAQUINONE
Formula: C16H14O5
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COMPUTED DESCRIPTORS

Molecular Weight 286.28 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 286.08412354 g/mol
Monoisotopic Mass 286.08412354 g/mol
Topological Polar Surface Area 80.7 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 509
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes