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99586-31-9

99586-31-9 structural image
Product Name: CHEMBRDG-BB 4010237
Formula: C13H8BrNO
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COMPUTED DESCRIPTORS

Molecular Weight 274.11 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 272.97893 g/mol
Monoisotopic Mass 272.97893 g/mol
Topological Polar Surface Area 26 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 248
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