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21811-73-4

21811-73-4 structural image
Product Name: 1-CARBOXYL-5,7-DIBROMO-6-HYDROXY-2,3,4-TRICHLOROXANTHONE
Formula: C14H3Br2Cl3O5
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COMPUTED DESCRIPTORS

Molecular Weight 519.3 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 517.75488 g/mol
Monoisotopic Mass 515.75693 g/mol
Topological Polar Surface Area 83.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 679
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes