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99027-88-0

99027-88-0 structural image
Product Name: Benzyl 3-oxa-2-aza-bicyclo[2.2.1]hept-5-ene-2-carboxylate
Formula: C13H13NO3
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COMPUTED DESCRIPTORS

Molecular Weight 231.25 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 231.08954328 g/mol
Monoisotopic Mass 231.08954328 g/mol
Topological Polar Surface Area 38.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 323
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