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4399-55-7

4399-55-7 structural image
Product Name: Direct Blue 71
Formula: C40H28N7NaO13S4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid; Water or Solvent Wet Solid
Chemical Classes Dyes -> Azo Dyes

COMPUTED DESCRIPTORS

Molecular Weight 1029.9 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 20
Rotatable Bond Count 6
Exact Mass 1028.9827456 g/mol
Monoisotopic Mass 1028.9827456 g/mol
Topological Polar Surface Area 383 Ų
Heavy Atom Count 68
Formal Charge 0
Complexity 2160
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 5
Compound Is Canonicalized Yes

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