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57131-19-8

57131-19-8 structural image
Product Name: Direct Black 166
Formula: C35H26N10O8S2.2Na
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COMPUTED DESCRIPTORS

Molecular Weight 824.8 g/mol
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 17
Rotatable Bond Count 8
Exact Mass 824.11718874 g/mol
Monoisotopic Mass 824.11718874 g/mol
Topological Polar Surface Area 333 Ų
Heavy Atom Count 57
Formal Charge 0
Complexity 1580
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

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