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477858-99-4

477858-99-4 structural image
Product Name: 4-(2-CHLOROPHENYL)-2-PHENYL-1,2-DIHYDRO-3H-PYRAZOL-3-ONE
Formula: C15H11ClN2O
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 40.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 270.71 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 270.0559907 g/mol
Monoisotopic Mass 270.0559907 g/mol
Topological Polar Surface Area 32.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 376
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