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84547-93-3

84547-93-3 structural image
Product Name: 4-BROMO-5-NITRO-1H-PYRAZOLE-3-CARBOXYLIC ACID
Formula: C4H2BrN3O4
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COMPUTED DESCRIPTORS

Molecular Weight 235.98 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 234.92287 g/mol
Monoisotopic Mass 234.92287 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 217
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