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946686-29-9

946686-29-9 structural image
Product Name: 5-(4-tert-Butylphenyl)cyclohexane-1,3-dione
Formula: C16H20O2
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COMPUTED DESCRIPTORS

Molecular Weight 244.33 g/mol
XLogP3 3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 244.146329876 g/mol
Monoisotopic Mass 244.146329876 g/mol
Topological Polar Surface Area 34.1 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 314
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