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111138-45-5

111138-45-5 structural image
Product Name: trans-1-Benzyl-5-(methoxycarbonyl)pyrrolidine-2-carboxylic acid
Formula: C14H17NO4
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COMPUTED DESCRIPTORS

Molecular Weight 263.29 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 263.11575802 g/mol
Monoisotopic Mass 263.11575802 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 338
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes