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77791-69-6

77791-69-6 structural image
Product Name: N-(2-oxo-3,5,7-cycloheptatrien-1-yl)aminooxoacetic acid ethyl ester
Formula: C11H11NO4
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COMPUTED DESCRIPTORS

Molecular Weight 211.21 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 211.08445790 g/mol
Monoisotopic Mass 211.08445790 g/mol
Topological Polar Surface Area 56.8 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 294
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