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200725-09-3

200725-09-3 structural image
Product Name: 4-OXO-4-(2-TRIFLUOROMETHYLPHENYL)BUTYRIC ACID
Formula: C11H9F3O3
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COMPUTED DESCRIPTORS

Molecular Weight 246.18 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 246.05037863 g/mol
Monoisotopic Mass 246.05037863 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 299
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