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338769-99-6

338769-99-6 structural image
Product Name: 1-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4,5-DIMETHYL-1,2-DIHYDRO-3H-PYRAZOL-3-ONE
Formula: C11H9ClF3N3O
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COMPUTED DESCRIPTORS

Molecular Weight 291.66 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 291.0386241 g/mol
Monoisotopic Mass 291.0386241 g/mol
Topological Polar Surface Area 45.2 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 424
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