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Homecas117835-08-2

117835-08-2

117835-08-2 structural image
Product Name: 5-PHENYL-2,4-PYRROLIDINEDICARBOXYLIC ACID
Formula: C12H13NO4
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COMPUTED DESCRIPTORS

Molecular Weight 235.24 g/mol
XLogP3 -1.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 235.08445790 g/mol
Monoisotopic Mass 235.08445790 g/mol
Topological Polar Surface Area 86.6 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 312
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes