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3529-01-9

3529-01-9 structural image
Product Name: ACID BLUE 120
Formula: C33H23N5Na2O6S2
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COMPUTED DESCRIPTORS

Molecular Weight 695.7 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 6
Exact Mass 695.08851438 g/mol
Monoisotopic Mass 695.08851438 g/mol
Topological Polar Surface Area 193 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 1270
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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