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84-40-2

84-40-2 structural image
Product Name: C.I.Vat Blue 35
Formula: C16H8Br2N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 420.05 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 419.89320 g/mol
Monoisotopic Mass 417.89525 g/mol
Topological Polar Surface Area 65.4 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 512
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