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883544-59-0

883544-59-0 structural image
Product Name: 2-(3-METHYLPIPERIDIN-1-YL)-ISONICOTINIC ACID HYDROCHLORIDE
Formula: C12H16N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 220.27 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 220.121177757 g/mol
Monoisotopic Mass 220.121177757 g/mol
Topological Polar Surface Area 53.4 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 257
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes