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72704-31-5

72704-31-5 structural image
Product Name: 1-Methyl-5-oxo-2-phenyl-pyrrolidine-3-carboxylic acid
Formula: C12H13NO3
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COMPUTED DESCRIPTORS

Molecular Weight 219.24 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 219.08954328 g/mol
Monoisotopic Mass 219.08954328 g/mol
Topological Polar Surface Area 57.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 297
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