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7194-78-7

7194-78-7 structural image
Product Name: 2-(3-broMophenyl)-2-oxoacetic acid
Formula: C8H5BrO3
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COMPUTED DESCRIPTORS

Molecular Weight 229.03 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 227.94221 g/mol
Monoisotopic Mass 227.94221 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 203
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