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951889-49-9

951889-49-9 structural image
Product Name: Ethyl 5-(2,4,6-trimethylphenyl)-5-oxovalerate
Formula: C16H22O3
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COMPUTED DESCRIPTORS

Molecular Weight 262.34 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 262.15689456 g/mol
Monoisotopic Mass 262.15689456 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 19
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