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898792-55-7

898792-55-7 structural image
Product Name: 5-(3,5-DIMETHOXYPHENYL)-5-OXOVALERIC ACID
Formula: C13H16O5
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COMPUTED DESCRIPTORS

Molecular Weight 252.26 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 252.09977361 g/mol
Monoisotopic Mass 252.09977361 g/mol
Topological Polar Surface Area 72.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 277
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