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1217748-72-5

1217748-72-5 structural image
Product Name: (2S,4S)-1-(TERT-BUTOXYCARBONYL)-4-(3-ISOPROPYL-PHENOXY)-2-PYRROLIDINECARBOXYLIC ACID
Formula: C19H27NO5
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COMPUTED DESCRIPTORS

Molecular Weight 349.4 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 349.18892296 g/mol
Monoisotopic Mass 349.18892296 g/mol
Topological Polar Surface Area 76.1 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 485
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