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956958-63-7

956958-63-7 structural image
Product Name: L-Isoleucine, N-(4-chlorobenzoyl)-
Formula: C13H16ClNO3
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COMPUTED DESCRIPTORS

Molecular Weight 269.72 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 269.0818711 g/mol
Monoisotopic Mass 269.0818711 g/mol
Topological Polar Surface Area 66.4 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 301
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