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115172-96-8

115172-96-8 structural image
Product Name: BENZYL CYANOMETHYLETHYLCARBAMATE
Formula: C12H14N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 218.25 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 218.105527694 g/mol
Monoisotopic Mass 218.105527694 g/mol
Topological Polar Surface Area 53.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 263
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