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Nitroxynil

CAT: 1410-M34908-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:1410-M34908-01Size:1 g
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Description
Nitroxynil (4-Hydroxy-3-iodo-5-nitrobenzonitrile) is an anthelmintic compound that effectively targets parasites in both adult and immature stages. It is extensively employed in investigations pertaining to Fasciola hepatica infection.
CAS Number
1689-89-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
290.01
Molecular Formula
C7H3IN2O3
Notes
Research use only, not for human use.
Receptor
Parasite

Chemical Information

Nitroxynil

Nitroxinil is a small molecule drug. The usage of the INN stem '-nil' in the name indicates that Nitroxinil is a benzodiazepine receptor antagonist/agonist. Nitroxinil has a monoisotopic molecular weight of 289.92 Da.

CAS Number1689-89-0
PubChem CID15532
IUPAC Name4-hydroxy-3-iodo-5-nitrobenzonitrile
Molecular FormulaC7H3IN2O3
Molecular Weight290.01
XLogP2.3
Topological Polar Surface Area89.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity256
SMILES
C1=C(C=C(C(=C1[N+](=O)[O-])O)I)C#N
InChI
InChI=1S/C7H3IN2O3/c8-5-1-4(3-9)2-6(7(5)11)10(12)13/h1-2,11H
InChIKey
SGKGVABHDAQAJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nitroxynil
CAS: 1689-89-0
CID: 15532
Formula: C7H3IN2O3
MW: 290.01
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight290.01
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass289.91884
Monoisotopic Mass289.91884
Topological Polar Surface Area89.8 Ų
Heavy Atom Count13
Formal Charge0
Complexity256
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes