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215656-70-5

215656-70-5 structural image
Product Name: 4-[2-(2-OXO-PYRROLIDIN-1-YL)-ETHOXY]-BENZOIC ACID
Formula: C13H15NO4
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 27.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 249.26 g/mol
XLogP3 1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 249.10010796 g/mol
Monoisotopic Mass 249.10010796 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 310
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