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71173-77-8

71173-77-8 structural image
Product Name: 4,5-Dihydro-5-oxo-1H-pyrazole-3-carboxylic acid
Formula: C4H4N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 128.09 g/mol
XLogP3 -0.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 128.02219199 g/mol
Monoisotopic Mass 128.02219199 g/mol
Topological Polar Surface Area 78.8 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 196
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