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116052-00-7

116052-00-7 structural image
Product Name: 8-BENZYL (S)-2-AMINOOCTANEDIOATE
Formula: C15H21NO4
Synonyms: ω-Benzyl (S)-2-aminosuberate
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COMPUTED DESCRIPTORS

Molecular Weight 279.33 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 10
Exact Mass 279.14705815 g/mol
Monoisotopic Mass 279.14705815 g/mol
Topological Polar Surface Area 89.6 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 300
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes