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33548-33-3

33548-33-3 structural image
Product Name: 6-OXO-1-PHENYL-1,4,5,6-TETRAHYDRO-PYRIDAZINE-3-CARBOXYLIC ACID
Formula: C11H10N2O3
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 26.8 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 218.21 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 218.06914219 g/mol
Monoisotopic Mass 218.06914219 g/mol
Topological Polar Surface Area 70 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 332
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