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898751-75-2

898751-75-2 structural image
Product Name: ETHYL 6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOATE
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 8
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 288
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