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869681-96-9

869681-96-9 structural image
Product Name: (2S,4S)-1-(TERT-BUTOXYCARBONYL)-4-(3-FLUORO-PHENOXY)-2-PYRROLIDINECARBOXYLIC ACID
Formula: C16H20FNO5
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COMPUTED DESCRIPTORS

Molecular Weight 325.33 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 325.13255090 g/mol
Monoisotopic Mass 325.13255090 g/mol
Topological Polar Surface Area 76.1 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 450
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