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16459-34-0

16459-34-0 structural image
Product Name: ETHYL 5-AMINO-1-(3-NITROPHENYL)PYRAZOLE-4-CARBOXYLATE
Formula: C12H12N4O4
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COMPUTED DESCRIPTORS

Molecular Weight 276.25 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 276.08585488 g/mol
Monoisotopic Mass 276.08585488 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 373
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