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13161-30-3

13161-30-3 | 2-Pyridinol, 1-oxide

CAS No: 13161-30-3 Catalog No: AG000ZIF MDL No:MFCD00006195

Product Description

Catalog Number:
AG000ZIF
Chemical Name:
2-Pyridinol, 1-oxide
CAS Number:
13161-30-3
Molecular Formula:
C5H5NO2
Molecular Weight:
111.0987
MDL Number:
MFCD00006195
IUPAC Name:
1-hydroxypyridin-2-one
InChI:
InChI=1S/C5H5NO2/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChI Key:
SNUSZUYTMHKCPM-UHFFFAOYSA-N
SMILES:
Oc1cccc[n+]1[O-]
UNII:
YO3915897S
NSC Number:
406972

Properties

Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.032g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
111.1g/mol
Monoisotopic Mass:
111.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

Literature

Title Journal
Characterization of cobalt(III) hydroxamic acid complexes based on a tris(2-pyridylmethyl)amine scaffold: reactivity toward cysteine methyl ester. Inorganic chemistry 20120903
Versatile effects of aurone structure on mushroom tyrosinase activity. Chembiochem : a European journal of chemical biology 20120305
Differentiation of isomeric hydroxypyridine N-oxides using metal complexation and electrospray ionization mass spectrometry. Journal of the American Society for Mass Spectrometry 20110301
Identifying chelators for metalloprotein inhibitors using a fragment-based approach. Journal of medicinal chemistry 20110127
Eu(III) complexes of functionalized octadentate 1-hydroxypyridin-2-ones: stability, bioconjugation, and luminescence resonance energy transfer studies. Inorganic chemistry 20101101
An experimental and computational study on the dissociation behavior of hydroxypyridine N-oxides in atmospheric pressure ionization mass spectrometry. Journal of mass spectrometry : JMS 20100501
Sulfonate esters of 1-hydroxypyridin-2(1H)-one and ethyl 2-cyano-2-(hydroxyimino)acetate (oxyma) as effective peptide coupling reagents to replace 1-hydroxybenzotriazole and 1-hydroxy-7-azabenzotriazole. Chemical & pharmaceutical bulletin 20100401
A direct LC/MS/MS method for the determination of ciclopirox penetration across human nail plate in in vitro penetration studies. Journal of pharmaceutical and biomedical analysis 20100105
Photolabile N-hydroxypyrid-2(1H)-one derivatives of guanine nucleosides: a new method for independent guanine radical generation. Organic & biomolecular chemistry 20091207
Titanium(IV) complexes with N,N'-dialkyl-2,3-dihydroxyterephthalamides and 1-hydroxy-2(1H)-pyridinone as siderophore and tunichrome analogues. Inorganic chemistry 20091116
Aryl bridged 1-hydroxypyridin-2-one: effect of the bridge on the Eu(III) sensitization process. Inorganic chemistry 20091005
Selective removal of lanthanides from natural waters, acidic streams and dialysate. Journal of hazardous materials 20090915
Circularly polarized luminescence in enantiopure europium and terbium complexes with modular, all-oxygen donor ligands. Inorganic chemistry 20090907
From antenna to assay: lessons learned in lanthanide luminescence. Accounts of chemical research 20090421
Isolation of 2-pyridone alkaloids from a New Zealand marine-derived penicillium species. Journal of natural products 20090327
Synthesis and characterization of mononuclear hydroxamato and hydroximato complexes of iron(III) based on the tris-(2-pyridylmethyl)amine ligand. Dalton transactions (Cambridge, England : 2003) 20081207
Synthesis of celecoxib analogs that possess a N-hydroxypyrid-2(1H)one 5-lipoxygenase pharmacophore: biological evaluation as dual inhibitors of cyclooxygenases and 5-lipoxygenase with anti-inflammatory activity. Bioorganic & medicinal chemistry letters 20081201
Aryl-bridged 1-hydroxypyridin-2-one: sensitizer ligands for Eu(III). Inorganic chemistry 20080721
Synthesis and biological evaluation of 1-(benzenesulfonamido)-2-[5-(N-hydroxypyridin-2(1H)-one)]acetylene regioisomers: a novel class of 5-lipoxygenase inhibitors. Bioorganic & medicinal chemistry letters 20080715
Highly luminescent lanthanide complexes of 1-hydroxy-2-pyridinones. Inorganic chemistry 20080421
Diaqua-bis(picolinato N-oxide-κO,O')zinc(II). Acta crystallographica. Section E, Structure reports online 20080101
Improved determination of structural changes of 2-pyridone-(H2O)1 upon electronic excitation. The journal of physical chemistry. A 20070503
A three-dimensional framework structure constructed from 2-(2-pyridyl-N-oxide) ethylphosphonic acid and Nd(III). Inorganic chemistry 20060501
The relative and absolute configuration of PF1140. The Journal of antibiotics 20050601
Paecilosetin, a new bioactive fungal metabolite from a New Zealand isolate of Paecilomyces farinosus. Journal of natural products 20050501
An unusual oxidative cyclization: studies towards the biomimetic synthesis of pyridomacrolidin. Organic letters 20030626
Examination of novel zinc-binding groups for use in matrix metalloproteinase inhibitors. Inorganic chemistry 20030602

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