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1381947-36-9

1381947-36-9 structural image
Product Name: BOC-(TRANS)-4-(2-TRIFLUOROMETHYL-PHENYL)-PYRROLIDINE-3-CARBOXYLIC ACID
Formula: C17H20F3NO4
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COMPUTED DESCRIPTORS

Molecular Weight 359.34 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 359.13444261 g/mol
Monoisotopic Mass 359.13444261 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 515
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