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71418-45-6

71418-45-6 structural image
Product Name: BroMotriMethylaMMoniuMbiMane BroMide
Formula: C13H19Br2N3O2
Synonyms: (Trimethylammonio)monobromobimane;5-(Bromomethyl)-N,N,N,2,6-pentamethyl-1,7-dioxo-1H,7H-pyrazolo[1,2-a]pyrazole-3-methanaminium bromide;Brombimane q;qBBr;Thiolye MQ
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COMPUTED DESCRIPTORS

Molecular Weight 409.12 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 408.98235 g/mol
Monoisotopic Mass 406.98440 g/mol
Topological Polar Surface Area 40.6 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 529
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 2
Compound Is Canonicalized Yes