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33284-45-6

33284-45-6 structural image
Product Name: 1,1,1-trifluoro-5-methylheptane-2,4-dione
Formula: C8H11F3O2
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COMPUTED DESCRIPTORS

Molecular Weight 196.17 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 196.07111408 g/mol
Monoisotopic Mass 196.07111408 g/mol
Topological Polar Surface Area 34.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 208
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes