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35166-20-2

35166-20-2 structural image
Product Name: Ethanone, 1-(3,5-dimethyl-4-isoxazolyl)- (9CI)
Formula: C7H9NO2
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COMPUTED DESCRIPTORS

Molecular Weight 139.15 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 139.063328530 g/mol
Monoisotopic Mass 139.063328530 g/mol
Topological Polar Surface Area 43.1 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 147
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