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299404-81-2

299404-81-2 structural image
Product Name: CHEMBRDG-BB 5469887
Formula: C13H13BrN2O3
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COMPUTED DESCRIPTORS

Molecular Weight 325.16 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 324.01095 g/mol
Monoisotopic Mass 324.01095 g/mol
Topological Polar Surface Area 67.4 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 422
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