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1161787-85-4

1161787-85-4 structural image
Product Name: Boc-(+/-)-trans-4-(3-MethoxyMethyl-phenyl)-pyrrolidine-3-carboxylic acid
Formula: C18H25NO5
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COMPUTED DESCRIPTORS

Molecular Weight 335.4 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 335.17327290 g/mol
Monoisotopic Mass 335.17327290 g/mol
Topological Polar Surface Area 76.1 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 459
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