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164670-73-9

164670-73-9 structural image
Product Name: 5-BROMO-2,3-DIMETHOXY-BENZONITRILE
Formula: C9H8BrNO2
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COMPUTED DESCRIPTORS

Molecular Weight 242.07 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 240.97384 g/mol
Monoisotopic Mass 240.97384 g/mol
Topological Polar Surface Area 42.2 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 213
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