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22314-94-9

22314-94-9 structural image
Product Name: 3-methylharman
Formula: C13H12N2
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COMPUTED DESCRIPTORS

Molecular Weight 196.25 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 196.100048391 g/mol
Monoisotopic Mass 196.100048391 g/mol
Topological Polar Surface Area 28.7 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 241
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