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338757-95-2

338757-95-2 structural image
Product Name: 1-[2,6-DINITRO-4-(TRIFLUOROMETHYL)PHENYL]TETRAHYDRO-4(1H)-PYRIDINONE
Formula: C12H10F3N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 333.22 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 1
Exact Mass 333.05725491 g/mol
Monoisotopic Mass 333.05725491 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 468
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