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76596-57-1

76596-57-1 structural image
Product Name: 3-bromo-alpha-[[(1,1-dimethylethyl)amino]methyl]isoxazole-5-methanol
Formula: C9H15BrN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 263.13 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 262.03169 g/mol
Monoisotopic Mass 262.03169 g/mol
Topological Polar Surface Area 58.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 184
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes