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13261-53-5

13261-53-5 structural image
Product Name: Imidodicarbonimidic diamide, N-1-naphthalenyl-
Formula: C12H13N5
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >34.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 227.27 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 227.11709544 g/mol
Monoisotopic Mass 227.11709544 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 319
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes