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100-54-9,MFCD00006372
Catalog No.:AA00004K

100-54-9 | 3-Cyanopyridine

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  • Technical Information
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Technical Information
Catalog Number:
AA00004K
Chemical Name:
3-Cyanopyridine
CAS Number:
100-54-9
Molecular Formula:
C6H4N2
Molecular Weight:
104.1094
MDL Number:
MFCD00006372
SMILES:
N#Cc1cccnc1
NSC Number:
17558
Properties
Properties
 
BP:
203°C at 760 mmHg  
Form:
Solid  
MP:
48-52 °C  
Refractive Index:
1.5242 (estimate)  
Solubility:
140g/l  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
111  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
0.2  

Literature

Title: Use of small-molecule crystal structures to address solubility in a novel series of G protein coupled receptor 119 agonists: optimization of a lead and in vivo evaluation.

Journal: Journal of medicinal chemistry 20120614

Title: Palladium(II) containing γ-Keggin silicodecatungstate that efficiently catalyzes hydration of nitriles.

Journal: Journal of the American Chemical Society 20120411

Title: An approach to the chemotaxonomic differentiation of two European dog's mercury species: Mercurialis annua L. and M. perennis L.

Journal: Chemistry & biodiversity 20120201

Title: Bis(O-ethyl dithio-carbonato-κS,S')bis-(pyridine-3-carbonitrile-κN)nickel(II).

Journal: Acta crystallographica. Section E, Structure reports online 20120101

Title: Synthesis and anti-inflammatory evaluation of new substituted 1-(3-chlorophenyl)-3-(4-methoxyphenyl)-1H-pyrazole derivatives.

Journal: Acta poloniae pharmaceutica 20120101

Title: A new nitrilase-producing strain named Rhodobacter sphaeroides LHS-305: biocatalytic characterization and substrate specificity.

Journal: Applied biochemistry and biotechnology 20111201

Title: Tetra-kis(3-cyano-pyridine-κN)bis-(thio-cyanato-κN)cobalt(II) 1,4-dioxane disolvate.

Journal: Acta crystallographica. Section E, Structure reports online 20111201

Title: Tetra-μ-acetato-κO:O'-bis-[(3-cyano-pyridine-κN)ruthenium(II,III)](Ru-Ru) hexa-fluoridophosphate 1,2-dichloro-ethane monosolvate.

Journal: Acta crystallographica. Section E, Structure reports online 20111101

Title: Characterization of a newly isolated strain Rhodococcus erythropolis ZJB-09149 transforming 2-chloro-3-cyanopyridine to 2-chloronicotinic acid.

Journal: New biotechnology 20111001

Title: Synthesis and anti-microbial activity of some 1- substituted amino-4,6-dimethyl-2-oxo-pyridine-3-carbonitrile derivatives.

Journal: European journal of medicinal chemistry 20111001

Title: An improved nitrilase-mediated bioprocess for synthesis of nicotinic acid from 3-cyanopyridine with hyperinduced Nocardia globerula NHB-2.

Journal: Journal of industrial microbiology & biotechnology 20110901

Title: Dibromidobis(pyridine-3-carbonitrile-κN)mercury(II).

Journal: Acta crystallographica. Section E, Structure reports online 20110501

Title: Synthesis of acyclovir and HBG analogues having nicotinonitrile and its 2-methyloxy 1,2,3-triazole.

Journal: Nucleosides, nucleotides & nucleic acids 20110501

Title: High-yield continuous production of nicotinic acid via nitrile hydratase-amidase cascade reactions using cascade CSMRs.

Journal: Enzyme and microbial technology 20110407

Title: Pyridine-3-carboxamidinium chloride.

Journal: Acta crystallographica. Section E, Structure reports online 20110401

Title: Heterologous expression, purification and characterization of nitrilase from Aspergillus niger K10.

Journal: BMC biotechnology 20110101

Title: Dibromidobis(pyridine-3-carbonitrile-κN)zinc(II).

Journal: Acta crystallographica. Section E, Structure reports online 20110101

Title: Cloning, expression and functional analysis of nicotinate dehydrogenase gene cluster from Comamonas testosteroni JA1 that can hydroxylate 3-cyanopyridine.

Journal: Biodegradation 20100701

Title: 6-(4-Amino-phen-yl)-2-eth-oxy-4-(2-thien-yl)nicotinonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20100701

Title: Generation of mutant of Rhodococcus rhodochrous PA-34 through chemical mutagenesis for hyperproduction of nitrile hydratase.

Journal: Acta microbiologica et immunologica Hungarica 20100601

Title: Optimization of 5-vinylaryl-3-pyridinecarbonitriles as PKCtheta inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20100315

Title: 6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,5-trimethoxy-phen-yl)nicotinonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20100301

Title: Solid and liquid charge-transfer complex formation between 1-methylnaphthalene and 1-alkyl-cyanopyridinium bis{(trifluoromethyl)sulfonyl}imide ionic liquids.

Journal: Physical chemistry chemical physics : PCCP 20100227

Title: 6-(4-Bromo-phen-yl)-2-eth-oxy-4-(4-ethoxy-phen-yl)nicotinonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20100101

Title: New pyridone, thioxopyridine, pyrazolopyridine and pyridine derivatives that modulate inflammatory mediators in stimulated RAW 264.7 murine macrophage.

Journal: European journal of medicinal chemistry 20091101

Title: Fluorescence properties of donor acceptor chromophores on newly synthesized pyridine-3-carbonitriles.

Journal: Journal of fluorescence 20091101

Title: 6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,6-trimethoxy-phen-yl)nicotinonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20091101

Title: C-5 substituted heteroaryl-3-pyridinecarbonitriles as PKCtheta inhibitors: part II.

Journal: Bioorganic & medicinal chemistry letters 20091001

Title: Pyridine-3-carbonitrile-chloranilic acid-acetonitrile (2/1/2).

Journal: Acta crystallographica. Section E, Structure reports online 20091001

Title: Purification of a hyperactive nitrile hydratase from resting cells of Rhodococcus rhodochrous PA-34.

Journal: Indian journal of microbiology 20090901

Title: New catalytic liquid-phase ammoxidation approach to the preparation of niacin (vitamin B3).

Journal: Langmuir : the ACS journal of surfaces and colloids 20090707

Title: Optimization of 5-phenyl-3-pyridinecarbonitriles as PKCtheta inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20090701

Title: Synthesis and therapeutic evaluation of pyridyl based novel mTOR inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20090601

Title: Optimization of crucial reaction conditions for the production of nicotinamide by nitrile hydratase using response surface methodology.

Journal: Applied biochemistry and biotechnology 20081201

Title: Design and campaign synthesis of pyridine-based histone deacetylase inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20080415

Title: Characterisation of the substrate specificity of the nitrile hydrolyzing system of the acidotolerant black yeast Exophiala oligosperma R1.

Journal: Studies in mycology 20080101

Title: Reactions of sulphate radicals with substituted pyridines: a structure-reactivity correlation analysis.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry 20071203

Title: Cyanopyridyl containing 1,4-dihydroindeno[1,2-c]pyrazoles as potent checkpoint kinase 1 inhibitors: improving oral biovailability.

Journal: Bioorganic & medicinal chemistry letters 20071015

Title: Novel synthesis of [1]-benzothiepino[5,4-b]pyridine-3-carbonitriles and their anti-inflammatory properties.

Journal: Bioorganic & medicinal chemistry 20070315

Title: Bench scale conversion of 3-cyanopyidine to nicotinamide using resting cells of Rhodococcus rhodochrous PA-34.

Journal: Indian journal of microbiology 20070301

Title: Isocyanide addition to pyridinium salts. Efficient entry into substituted nicotinonitrile derivatives.

Journal: Organic letters 20061207

Title: Purification and characterization of a nitrilase from Aspergillus niger K10.

Journal: Applied microbiology and biotechnology 20061201

Title: Hyperinduction of nitrilases in filamentous fungi.

Journal: Journal of industrial microbiology & biotechnology 20061101

Title: {Fe(3CNpy)2[Cu(3CNpy)(mu-CN)2]2}: a one-dimensional cyanide-based spin-crossover coordination polymer.

Journal: Inorganic chemistry 20060612

Title: Mild hydrolysis of nitriles by Fusarium solani strain O1.

Journal: Folia microbiologica 20060101

Title: Novel milrinone analogs of pyridine-3-carbonitrile derivatives as promising cardiotonic agents.

Journal: European journal of medicinal chemistry 20051201

Title: Kinetics and mechanisms of the electron transfer reactions of oxo-centred carboxylate bridged complexes, [Fe3(mu3-O)(O2CR)6L3]ClO4, with verdazyl radicals in acetonitrile solution.

Journal: Dalton transactions (Cambridge, England : 2003) 20050421

Title: Electron transfer kinetics and mechanistic study of the thionicotinamide coordinated to the pentacyanoferrate(III)/(II) complexes: a model system for the in vitro activation of thioamides anti-tuberculosis drugs.

Journal: Journal of inorganic biochemistry 20050201

Title: Supramolecular isomerism in spin crossover networks with aurophilic interactions.

Journal: Chemical communications (Cambridge, England) 20041021

Title: Synergy between spin crossover and metallophilicity in triple interpenetrated 3D nets with the NbO structure type.

Journal: Journal of the American Chemical Society 20031126

Title: Two-dimensional metamagnet composed of cyano-bridged CuII-WV bimetallic assembly.

Journal: Chemical communications (Cambridge, England) 20031121

Title: 2-(3-pyridyl)-1,3,8-triazanaphthalene, a product of the catalytic transformation of 3-cyanopyridine.

Journal: Acta crystallographica. Section C, Crystal structure communications 20030901

Title: A rapid and sensitive fluorometric assay method for the determination of nitrilase activity.

Journal: Biotechnology and applied biochemistry 20030601

Title: Solvent dynamical control of electron-transfer rates in mixed-valence complexes observed by infrared spectral line shape coalescence.

Journal: Journal of the American Chemical Society 20020605

Title: New 3-pyridinecarbonitrile derivatives and their antimicrobial properties.

Journal: Bollettino chimico farmaceutico 20020101

Title: Three-dimensional open frameworks based on cobalt(II) and nickel(II) m-pyridinecarboxylates.

Journal: Inorganic chemistry 20010827

Title: Isolation and characterization of a bacterium possessing a novel aldoxime-dehydration activity and nitrile-degrading enzymes.

Journal: Archives of microbiology 19980801

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