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21640-35-7

21640-35-7 structural image
Product Name: 2-BENZYL-ISOQUINOLINE-1,3,4-TRIONE
Formula: C16H11NO3
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COMPUTED DESCRIPTORS

Molecular Weight 265.26 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 265.07389321 g/mol
Monoisotopic Mass 265.07389321 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 425
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes