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12392-64-2

12392-64-2 structural image
Product Name: ACID BLUE 161, PURE
Formula: C40H23CrN4NaO10S2-
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COMPUTED DESCRIPTORS

Molecular Weight 881.7 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 5
Exact Mass 881.005604 g/mol
Monoisotopic Mass 881.005604 g/mol
Topological Polar Surface Area 270 Ų
Heavy Atom Count 59
Formal Charge 0
Complexity 1340
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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