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878046-68-5

878046-68-5 structural image
Product Name: 4-(5-METHYL-2-OXO-BENZOOXAZOL-3-YL)-BUTYRIC ACID
Formula: C12H13NO4
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COMPUTED DESCRIPTORS

Molecular Weight 235.24 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 235.08445790 g/mol
Monoisotopic Mass 235.08445790 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 318
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