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898751-72-9

898751-72-9 structural image
Product Name: ETHYL 5-(3,5-DIMETHYLPHENYL)-5-OXOVALERATE
Formula: C15H20O3
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COMPUTED DESCRIPTORS

Molecular Weight 248.32 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 248.14124450 g/mol
Monoisotopic Mass 248.14124450 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 276
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