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478041-28-0

478041-28-0 structural image
Product Name: Spiro[2.5]octane-1,1-dicarbonitrile, 2-(4-methoxyphenyl)-6,6-dimethyl-4,8-dioxo-
Formula: C19H18N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 322.4 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 322.13174244 g/mol
Monoisotopic Mass 322.13174244 g/mol
Topological Polar Surface Area 91 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 646
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