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111821-05-7

111821-05-7 structural image
Product Name: (S)-OCTAHYDRO-INDOLE-2-CARBOXYLIC ACID TERT-BUTYL ESTER
Formula: C13H23NO2
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COMPUTED DESCRIPTORS

Molecular Weight 225.33 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 225.172878976 g/mol
Monoisotopic Mass 225.172878976 g/mol
Topological Polar Surface Area 38.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 270
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes