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83181-47-9

83181-47-9 structural image
Product Name: N-(Ethyl-2-diazomalonyl)thyroxine
Formula: C20H15I4N3O7
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COMPUTED DESCRIPTORS

Molecular Weight 917.0 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 10
Exact Mass 916.7089 g/mol
Monoisotopic Mass 916.7089 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 789
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes