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42808-05-9

42808-05-9 structural image
Product Name: DANSYL-DL-VALINE CYCLOHEXYLAMMONIUM SALT
Formula: C17H22N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 449.6 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 449.23482778 g/mol
Monoisotopic Mass 449.23482778 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 587
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes