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128972-00-9

128972-00-9 structural image
Product Name: 3-(2-METHYLPROPYL)-5-PHENYL-2(1H)-PYRAZINONE
Formula: C14H16N2O
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COMPUTED DESCRIPTORS

Molecular Weight 228.29 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 228.126263138 g/mol
Monoisotopic Mass 228.126263138 g/mol
Topological Polar Surface Area 41.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 349
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