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439108-08-4

439108-08-4 structural image
Product Name: [4,5-DIBROMO-6-OXO-1(6H)-PYRIDAZINYL]METHYL 2,6-DIFLUOROBENZENECARBOXYLATE
Formula: C12H6Br2F2N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 423.99 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 423.86927 g/mol
Monoisotopic Mass 421.87132 g/mol
Topological Polar Surface Area 59 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 503
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