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114369-43-6,MFCD01632336
Catalog No.:AA000B3E

114369-43-6 | 1H-1,2,4-Triazole-1-propanenitrile, α-[2-(4-chlorophenyl)ethyl]-α-phenyl-

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100mg
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000B3E
Chemical Name:
1H-1,2,4-Triazole-1-propanenitrile, α-[2-(4-chlorophenyl)ethyl]-α-phenyl-
CAS Number:
114369-43-6
Molecular Formula:
C19H17ClN4
Molecular Weight:
336.8181
MDL Number:
MFCD01632336
SMILES:
N#CC(c1ccccc1)(Cn1cncn1)CCc1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
434  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.2  

Literature

Title: Protocol for an electrospray ionization tandem mass spectral product ion library: development and application for identification of 240 pesticides in foods.

Journal: Analytical chemistry 20120703

Title: Environmental behavior of the chiral triazole fungicide fenbuconazole and its chiral metabolites: enantioselective transformation and degradation in soils.

Journal: Environmental science & technology 20120306

Title: Orchard factors associated with resistance and cross resistance to sterol demethylation inhibitor fungicides in populations of Venturia inaequalis from Pennsylvania.

Journal: Phytopathology 20120301

Title: Simultaneous enantioselective determination of triazole fungicides in soil and water by chiral liquid chromatography/tandem mass spectrometry.

Journal: Journal of chromatography. A 20120210

Title: Oligo-DNA custom macroarray for monitoring major pathogenic and non-pathogenic fungi and bacteria in the phyllosphere of apple trees.

Journal: PloS one 20120101

Title: Ovariectomized mouse uterotrophic assay of 36 chemicals.

Journal: The Journal of toxicological sciences 20120101

Title: Residue analysis and degradation studies of fenbuconazole and myclobutanil in strawberry by chiral high-performance liquid chromatography-tandem mass spectrometry.

Journal: Journal of agricultural and food chemistry 20111123

Title: Simultaneous enantioselective determination of fenbuconazole and its main metabolites in soil and water by chiral liquid chromatography/tandem mass spectrometry.

Journal: Journal of chromatography. A 20110923

Title: Enantiomeric separation of triazole fungicides with 3-μm and 5-μml particle chiral columns by reverse-phase high-performance liquid chromatography.

Journal: Chirality 20110701

Title: Comparative impact of artificial selection for fungicide resistance on Beauveria bassiana and Metarhizium brunneum.

Journal: Environmental entomology 20110201

Title: Evaluation of computational docking to identify pregnane X receptor agonists in the ToxCast database.

Journal: Environmental health perspectives 20101001

Title: High levels of miticides and agrochemicals in North American apiaries: implications for honey bee health.

Journal: PloS one 20100101

Title: Toxicity of six novel fungicides and sulphur to Galendromus occidentalis (Acari: Phytoseiidae).

Journal: Experimental & applied acarology 20090101

Title: On-line preconcentration and chiral separation of propiconazole by cyclodextrin-modified micellar electrokinetic chromatography.

Journal: Journal of chromatography. A 20071102

Title: Modulation of aromatase activity and mRNA by various selected pesticides in the human choriocarcinoma JEG-3 cell line.

Journal: Toxicology 20061110

Title: Inhibition of rainbow trout (Oncorhynchus mykiss) P450 aromatase activities in brain and ovarian microsomes by various environmental substances.

Journal: Comparative biochemistry and physiology. Toxicology & pharmacology : CBP 20061101

Title: Activation of alpha- and beta-estrogen receptors by persistent pesticides in reporter cell lines.

Journal: Life sciences 20060815

Title: The effect of fenbuconazole on cell proliferation and enzyme induction in the liver of female CD1 mice.

Journal: Toxicology and applied pharmacology 20060715

Title: Occurrence, Distribution, and Polymerase Chain Reaction-Based Detection of Resistance to Sterol Demethylation Inhibitor Fungicides in Populations of Blumeriella jaapii in Michigan.

Journal: Phytopathology 20060701

Title: Identification of new human pregnane X receptor ligands among pesticides using a stable reporter cell system.

Journal: Toxicological sciences : an official journal of the Society of Toxicology 20060601

Title: Quantification of voriconazole in plasma by liquid chromatography-tandem mass spectrometry.

Journal: Clinical chemistry and laboratory medicine 20050101

Title: Determination of 22 triazole compounds including parent fungicides and metabolites in apples, peaches, flour, and water by liquid chromatography/tandem mass spectrometry.

Journal: Journal of AOAC International 20050101

Title: Altered gene expression in human cells induced by the agricultural chemical Enable.

Journal: Toxicology and industrial health 20040901

Title: Application of liquid chromatography with electrospray tandem mass spectrometry to the determination of a new generation of pesticides in processed fruits and vegetables.

Journal: Journal of chromatography. A 20040521

Title: Sub-lethal effects of a copper sulfate fungicide on development and reproduction in three coccinellid species.

Journal: Journal of insect science (Online) 20030101

Title: The potential for enhanced fungicide resistance in Beauveria bassiana through strain discovery and artificial selection.

Journal: Journal of invertebrate pathology 20021001

Title: Comparative residual toxicities of pesticides to the predator Agistemus industani (Acari: Stigmaeidae) on citrus in Florida.

Journal: Experimental & applied acarology 20010101

Title: Responses of two ladybeetles to eight fungicides used in Florida citrus: implications for biological control.

Journal: Journal of insect science (Online) 20010101

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Tags:114369-43-6 Molecular Formula|114369-43-6 MDL|114369-43-6 SMILES|114369-43-6 1H-1,2,4-Triazole-1-propanenitrile, α-[2-(4-chlorophenyl)ethyl]-α-phenyl-