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80030-79-1

80030-79-1 structural image
Product Name: 1H-Pyrazole-3-carboxamide, 5-methyl-4-nitro-N-(phenylmethyl)-
Formula: C12H12N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 260.25 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 260.09094026 g/mol
Monoisotopic Mass 260.09094026 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 338
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