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898767-28-7

898767-28-7 structural image
Product Name: 4-(4-BROMO-2-METHYLPHENYL)-4-OXOBUTYRIC ACID
Formula: C11H11BrO3
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COMPUTED DESCRIPTORS

Molecular Weight 271.11 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 269.98916 g/mol
Monoisotopic Mass 269.98916 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 252
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