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1213911-00-2

1213911-00-2 structural image
Product Name: Benzeneethanol, β-amino-2-bromo-4,5-dimethoxy-, (βS)-
Formula: C10H14BrNO3
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COMPUTED DESCRIPTORS

Molecular Weight 276.13 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 275.01571 g/mol
Monoisotopic Mass 275.01571 g/mol
Topological Polar Surface Area 64.7 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 194
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes