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101708-53-6

101708-53-6 structural image
Product Name: 1-HYDROXY-2-(2-HYDROXY-5-SULFO-PHENYLAZO)-3,6-DISULFO-8-ACETAMINO-NAPHTHALINE
Formula: C18H15N3O12S3
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COMPUTED DESCRIPTORS

Molecular Weight 561.5 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 6
Exact Mass 560.98178644 g/mol
Monoisotopic Mass 560.98178644 g/mol
Topological Polar Surface Area 283 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 1170
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