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86288-08-6

86288-08-6 structural image
Product Name: S-2--Bromo -4-imidazole propionic acid
Formula: C6H7BrN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 219.04 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 217.96909 g/mol
Monoisotopic Mass 217.96909 g/mol
Topological Polar Surface Area 66 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 154
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