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959575-40-7

959575-40-7 structural image
Product Name: Boc-(±)-trans-4-(2-bromo-phenyl)-pyrrolidine-3-carboxylic acid
Formula: C16H20BrNO4
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COMPUTED DESCRIPTORS

Molecular Weight 370.24 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 369.05757 g/mol
Monoisotopic Mass 369.05757 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 434
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