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115687-24-6

115687-24-6 structural image
Product Name: 1-BENZYL-4-METHYL-PYRROLIDINE-3-CARBONITRILE
Formula: C13H16N2
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COMPUTED DESCRIPTORS

Molecular Weight 200.28 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 200.131348519 g/mol
Monoisotopic Mass 200.131348519 g/mol
Topological Polar Surface Area 27 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 247
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes