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339099-76-2

339099-76-2 structural image
Product Name: 3-[(4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY)ANILINO)METHYLENE]-1,1,1,5,5,5-HEXAFLUORO-2,4-PENTANEDIONE
Formula: C18H8ClF9N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 506.7 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 5
Exact Mass 506.0079733 g/mol
Monoisotopic Mass 506.0079733 g/mol
Topological Polar Surface Area 71.8 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 757
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