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875156-74-4

875156-74-4 structural image
Product Name: [3,5-DIMETHYL-1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-PYRAZOL-4-YL](OXO)ACETIC ACID
Formula: C14H11F3N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 312.24 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 312.07217670 g/mol
Monoisotopic Mass 312.07217670 g/mol
Topological Polar Surface Area 72.2 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 455
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