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898788-13-1

898788-13-1 structural image
Product Name: 7-(3,5-DITRIFLUOROMETHYLPHENYL)-7-OXOHEPTANOIC ACID
Formula: C15H14F6O3
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COMPUTED DESCRIPTORS

Molecular Weight 356.26 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 7
Exact Mass 356.08471328 g/mol
Monoisotopic Mass 356.08471328 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 422
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