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477854-20-9

477854-20-9 structural image
Product Name: 6-ACETYL-2-(4-CHLOROPHENYL)-1,2,4-TRIAZINE-3,5(2H,4H)-DIONE
Formula: C11H8ClN3O3
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 39.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 265.65 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 265.0254188 g/mol
Monoisotopic Mass 265.0254188 g/mol
Topological Polar Surface Area 78.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 427
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