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861409-77-0

861409-77-0 structural image
Product Name: Benzenemethanamine, 5-bromo-N-(1,1-dimethylethyl)-2-methoxy-
Formula: C12H18BrNO
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COMPUTED DESCRIPTORS

Molecular Weight 272.18 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 271.05718 g/mol
Monoisotopic Mass 271.05718 g/mol
Topological Polar Surface Area 21.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 191
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