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104819-52-5

104819-52-5 structural image
Product Name: TIMTEC-BB SBB005634
Formula: C7H8BrNO2
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COMPUTED DESCRIPTORS

Molecular Weight 218.05 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 216.97384 g/mol
Monoisotopic Mass 216.97384 g/mol
Topological Polar Surface Area 31.4 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 123
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