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22931-53-9

22931-53-9 structural image
Product Name: 2-BENZYLTETRAHYDRO-1H-ISOINDOLE-1,3,5(2H,4H)-TRIONE
Formula: C15H15NO3
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COMPUTED DESCRIPTORS

Molecular Weight 257.28 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 257.10519334 g/mol
Monoisotopic Mass 257.10519334 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 412
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes