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1394827-14-5

1394827-14-5 structural image
Product Name: Boc-(+/-)-trans-4-(4-isopropyl-phenyl)-pyrrolidine-3-carboxylic acid
Formula: C19H27NO4
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COMPUTED DESCRIPTORS

Molecular Weight 333.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 333.19400834 g/mol
Monoisotopic Mass 333.19400834 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 461
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