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338975-57-8

338975-57-8 structural image
Product Name: 3-CHLORO-N'-([5-OXO-3-(TRIFLUOROMETHYL)-1,5-DIHYDRO-4H-PYRAZOL-4-YLIDEN]METHYL)BENZENECARBOHYDRAZIDE
Formula: C12H8ClF3N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 332.66 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 332.0287877 g/mol
Monoisotopic Mass 332.0287877 g/mol
Topological Polar Surface Area 82.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 533
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes