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2165463-89-6

2165463-89-6 structural image
Product Name: Carbamic acid, N-[(3S,4R)-3-(cyanomethyl)-4-piperidinyl]-, 1,1-dimethylethyl ester
Formula: C12H21N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 239.31 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 239.16337692 g/mol
Monoisotopic Mass 239.16337692 g/mol
Topological Polar Surface Area 74.2 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 313
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes