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4394-05-2

4394-05-2 structural image
Product Name: NIXYLIC ACID
Formula: C14H14N2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >36.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 242.27 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 242.105527694 g/mol
Monoisotopic Mass 242.105527694 g/mol
Topological Polar Surface Area 62.2 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 296
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