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502651-46-9

502651-46-9 structural image
Product Name: 7-OXO-7-(4-TRIFLUOROMETHYLPHENYL)HEPTANOIC ACID
Formula: C14H15F3O3
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COMPUTED DESCRIPTORS

Molecular Weight 288.26 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 288.09732882 g/mol
Monoisotopic Mass 288.09732882 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 331
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