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149771-11-9

149771-11-9 structural image
Product Name: ETHYL 2-PHENYL-4-(TRIFLUOROMETHYL)-5-PYRIMIDINECARBOXYLATE
Formula: C14H11F3N2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility <0.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 296.24 g/mol
XLogP3 3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 296.07726208 g/mol
Monoisotopic Mass 296.07726208 g/mol
Topological Polar Surface Area 52.1 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 357
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