200,000+ products from a single source!

sales@angenechem.com

Home > Pyridines > 100-54-9

100-54-9

100-54-9 | 3-Cyanopyridine

CAS No: 100-54-9 Catalog No: AG00007C MDL No:MFCD00006372

Product Description

Catalog Number:
AG00007C
Chemical Name:
3-Cyanopyridine
CAS Number:
100-54-9
Molecular Formula:
C6H4N2
Molecular Weight:
104.1094
MDL Number:
MFCD00006372
IUPAC Name:
pyridine-3-carbonitrile
InChI:
InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H
InChI Key:
GZPHSAQLYPIAIN-UHFFFAOYSA-N
SMILES:
N#Cc1cccnc1
EC Number:
202-863-0
UNII:
X64V0K6260
NSC Number:
17558

Properties

Complexity:
111  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.037g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
104.112g/mol
Monoisotopic Mass:
104.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

Literature

Title Journal
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 of medicinal chemistry 20120614
Palladium(II) containing γ-Keggin silicodecatungstate that efficiently catalyzes hydration of nitriles. Journal of the American Chemical Society 20120411
An approach to the chemotaxonomic differentiation of two European dog's mercury species: Mercurialis annua L. and M. perennis L. Chemistry & biodiversity 20120201
Bis(O-ethyl dithio-carbonato-κS,S')bis-(pyridine-3-carbonitrile-κN)nickel(II). Acta crystallographica. Section E, Structure reports online 20120101
Synthesis and anti-inflammatory evaluation of new substituted 1-(3-chlorophenyl)-3-(4-methoxyphenyl)-1H-pyrazole derivatives. Acta poloniae pharmaceutica 20120101
A new nitrilase-producing strain named Rhodobacter sphaeroides LHS-305: biocatalytic characterization and substrate specificity. Applied biochemistry and biotechnology 20111201
Tetra-kis(3-cyano-pyridine-κN)bis-(thio-cyanato-κN)cobalt(II) 1,4-dioxane disolvate. Acta crystallographica. Section E, Structure reports online 20111201
Tetra-μ-acetato-κO:O'-bis-[(3-cyano-pyridine-κN)ruthenium(II,III)](Ru-Ru) hexa-fluoridophosphate 1,2-dichloro-ethane monosolvate. Acta crystallographica. Section E, Structure reports online 20111101
Characterization of a newly isolated strain Rhodococcus erythropolis ZJB-09149 transforming 2-chloro-3-cyanopyridine to 2-chloronicotinic acid. New biotechnology 20111001
Synthesis and anti-microbial activity of some 1- substituted amino-4,6-dimethyl-2-oxo-pyridine-3-carbonitrile derivatives. European journal of medicinal chemistry 20111001
An improved nitrilase-mediated bioprocess for synthesis of nicotinic acid from 3-cyanopyridine with hyperinduced Nocardia globerula NHB-2. Journal of industrial microbiology & biotechnology 20110901
Dibromidobis(pyridine-3-carbonitrile-κN)mercury(II). Acta crystallographica. Section E, Structure reports online 20110501
Synthesis of acyclovir and HBG analogues having nicotinonitrile and its 2-methyloxy 1,2,3-triazole. Nucleosides, nucleotides & nucleic acids 20110501
High-yield continuous production of nicotinic acid via nitrile hydratase-amidase cascade reactions using cascade CSMRs. Enzyme and microbial technology 20110407
Pyridine-3-carboxamidinium chloride. Acta crystallographica. Section E, Structure reports online 20110401
Heterologous expression, purification and characterization of nitrilase from Aspergillus niger K10. BMC biotechnology 20110101
Dibromidobis(pyridine-3-carbonitrile-κN)zinc(II). Acta crystallographica. Section E, Structure reports online 20110101
Cloning, expression and functional analysis of nicotinate dehydrogenase gene cluster from Comamonas testosteroni JA1 that can hydroxylate 3-cyanopyridine. Biodegradation 20100701
6-(4-Amino-phen-yl)-2-eth-oxy-4-(2-thien-yl)nicotinonitrile. Acta crystallographica. Section E, Structure reports online 20100701
Generation of mutant of Rhodococcus rhodochrous PA-34 through chemical mutagenesis for hyperproduction of nitrile hydratase. Acta microbiologica et immunologica Hungarica 20100601
Optimization of 5-vinylaryl-3-pyridinecarbonitriles as PKCtheta inhibitors. Bioorganic & medicinal chemistry letters 20100315
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,5-trimethoxy-phen-yl)nicotinonitrile. Acta crystallographica. Section E, Structure reports online 20100301
Solid and liquid charge-transfer complex formation between 1-methylnaphthalene and 1-alkyl-cyanopyridinium bis{(trifluoromethyl)sulfonyl}imide ionic liquids. Physical chemistry chemical physics : PCCP 20100227
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(4-ethoxy-phen-yl)nicotinonitrile. Acta crystallographica. Section E, Structure reports online 20100101
New pyridone, thioxopyridine, pyrazolopyridine and pyridine derivatives that modulate inflammatory mediators in stimulated RAW 264.7 murine macrophage. European journal of medicinal chemistry 20091101
Fluorescence properties of donor acceptor chromophores on newly synthesized pyridine-3-carbonitriles. Journal of fluorescence 20091101
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,6-trimethoxy-phen-yl)nicotinonitrile. Acta crystallographica. Section E, Structure reports online 20091101
C-5 substituted heteroaryl-3-pyridinecarbonitriles as PKCtheta inhibitors: part II. Bioorganic & medicinal chemistry letters 20091001
Pyridine-3-carbonitrile-chloranilic acid-acetonitrile (2/1/2). Acta crystallographica. Section E, Structure reports online 20091001
Purification of a hyperactive nitrile hydratase from resting cells of Rhodococcus rhodochrous PA-34. Indian journal of microbiology 20090901
New catalytic liquid-phase ammoxidation approach to the preparation of niacin (vitamin B3). Langmuir : the ACS journal of surfaces and colloids 20090707
Optimization of 5-phenyl-3-pyridinecarbonitriles as PKCtheta inhibitors. Bioorganic & medicinal chemistry letters 20090701
Synthesis and therapeutic evaluation of pyridyl based novel mTOR inhibitors. Bioorganic & medicinal chemistry letters 20090601
Optimization of crucial reaction conditions for the production of nicotinamide by nitrile hydratase using response surface methodology. Applied biochemistry and biotechnology 20081201
Design and campaign synthesis of pyridine-based histone deacetylase inhibitors. Bioorganic & medicinal chemistry letters 20080415
Characterisation of the substrate specificity of the nitrile hydrolyzing system of the acidotolerant black yeast Exophiala oligosperma R1. Studies in mycology 20080101
Reactions of sulphate radicals with substituted pyridines: a structure-reactivity correlation analysis. Chemphyschem : a European journal of chemical physics and physical chemistry 20071203
Cyanopyridyl containing 1,4-dihydroindeno[1,2-c]pyrazoles as potent checkpoint kinase 1 inhibitors: improving oral biovailability. Bioorganic & medicinal chemistry letters 20071015
Novel synthesis of [1]-benzothiepino[5,4-b]pyridine-3-carbonitriles and their anti-inflammatory properties. Bioorganic & medicinal chemistry 20070315
Bench scale conversion of 3-cyanopyidine to nicotinamide using resting cells of Rhodococcus rhodochrous PA-34. Indian journal of microbiology 20070301
Isocyanide addition to pyridinium salts. Efficient entry into substituted nicotinonitrile derivatives. Organic letters 20061207
Purification and characterization of a nitrilase from Aspergillus niger K10. Applied microbiology and biotechnology 20061201
Hyperinduction of nitrilases in filamentous fungi. Journal of industrial microbiology & biotechnology 20061101
{Fe(3CNpy)2[Cu(3CNpy)(mu-CN)2]2}: a one-dimensional cyanide-based spin-crossover coordination polymer. Inorganic chemistry 20060612
Mild hydrolysis of nitriles by Fusarium solani strain O1. Folia microbiologica 20060101
Novel milrinone analogs of pyridine-3-carbonitrile derivatives as promising cardiotonic agents. European journal of medicinal chemistry 20051201
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. Dalton transactions (Cambridge, England : 2003) 20050421
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 of inorganic biochemistry 20050201
Supramolecular isomerism in spin crossover networks with aurophilic interactions. Chemical communications (Cambridge, England) 20041021
Synergy between spin crossover and metallophilicity in triple interpenetrated 3D nets with the NbO structure type. Journal of the American Chemical Society 20031126
Two-dimensional metamagnet composed of cyano-bridged CuII-WV bimetallic assembly. Chemical communications (Cambridge, England) 20031121
2-(3-pyridyl)-1,3,8-triazanaphthalene, a product of the catalytic transformation of 3-cyanopyridine. Acta crystallographica. Section C, Crystal structure communications 20030901
A rapid and sensitive fluorometric assay method for the determination of nitrilase activity. Biotechnology and applied biochemistry 20030601
Solvent dynamical control of electron-transfer rates in mixed-valence complexes observed by infrared spectral line shape coalescence. Journal of the American Chemical Society 20020605
New 3-pyridinecarbonitrile derivatives and their antimicrobial properties. Bollettino chimico farmaceutico 20020101
Three-dimensional open frameworks based on cobalt(II) and nickel(II) m-pyridinecarboxylates. Inorganic chemistry 20010827
Isolation and characterization of a bacterium possessing a novel aldoxime-dehydration activity and nitrile-degrading enzymes. Archives of microbiology 19980801

© 2019 Angene International Limited. All rights Reserved.