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4618-45-5

4618-45-5 structural image
Product Name: 4-(4'-HYDROXY-3'-IODOPHENOXY)-3,5-DIIODO-BENZOIC ACID
Formula: C13H7I3O4
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COMPUTED DESCRIPTORS

Molecular Weight 607.90 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 607.7479 g/mol
Monoisotopic Mass 607.7479 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 343
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