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6226-81-9

6226-81-9 structural image
Product Name: Orchil Red
Formula: C26H25N4NaO7S2
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COMPUTED DESCRIPTORS

Molecular Weight 612.6 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 5
Exact Mass 612.07252996 g/mol
Monoisotopic Mass 612.07252996 g/mol
Topological Polar Surface Area 201 Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 1110
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 3
Compound Is Canonicalized Yes