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120354-22-5

120354-22-5                                        structural image
Product Name: din-4-one
Formula: C12H15N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 249.33 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 249.09358328 g/mol
Monoisotopic Mass 249.09358328 g/mol
Topological Polar Surface Area 86.9 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 371
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