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bitertanol
1-(4-biphenylyloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanol

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Name:3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol
CAS Number: 55179-31-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:259-513-5
FDA UNII: GR7Z3Z59G9
Nikkaji Web:J11.455C
Beilstein Number:0620948
MDL:MFCD00055508
XlogP3-AA:4.20 (est)
Molecular Weight:337.42271000
Formula:C20 H23 N3 O2
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:herbicides / pesticides
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Soluble in:
 water, 5 mg/L @ 20 °C (exp)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Bitertanol 95%
Sigma-Aldrich
For experimental / research use only.
Bitertanol PESTANAL®, analytical standard
 
Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-dog LD50 > 5 mg/kg
Pesticide Manual. Vol. 9, Pg. 86, 1991.

oral-mouse LD50 4200 mg/kg
"Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A039, Pg. 1983,

intraperitoneal-rat LD50 725 mg/kg
LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: SLEEP GASTROINTESTINAL: OTHER CHANGES
National Technical Information Service. Vol. OTS0555457

oral-rat LD50 > 5 gm/kg
Defense des Vegetaux. Vol. 37, Pg. 206, 1983.

Dermal Toxicity:
subcutaneous-mouse LDLo 5 gm/kg
National Technical Information Service. Vol. OTS0555457

skin-rat LD50 > 5 gm/kg
Pesticide Manual. Vol. 9, Pg. 86, 1991.

Inhalation Toxicity:
inhalation-rat LC50 > 717 mg/m3/1H
Defense des Vegetaux. Vol. 37, Pg. 206, 1983.
 
Safety in Use Information:
Category:
herbicides / pesticides
Recommendation for bitertanol usage levels up to:
 not for fragrance use.
 
Recommendation for bitertanol flavor usage levels up to:
 not for flavor use.
 
Safety References:
European Food Safety Authority (EFSA) reference(s):

Review of the existing maximum residue levels for bitertanol according to Article 12 of Regulation (EC) No 396/2005
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :91656
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol
Chemidplus:0055179312
RTECS:XZ4803050 for cas# 55179-31-2
 
References:
 3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):91656
Pubchem (sid):135047627
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEBI:View
CHEMBL:View
KEGG (GenomeNet):C11258
HMDB (The Human Metabolome Database):Search
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
b-[(1,1'-biphenyl)-4-yloxy]-a-(1,1-dimethylethyl)-1H-1,2,4-triazol-1-ethanol
1-(4-biphenylyloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanol
3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol
1H-1,2,4-triazole-1-ethanol, b-([1,1'-biphenyl]-4-yloxy)-a-(1,1-dimethylethyl)-
 

Articles:

PubMed:Effects of currently used pesticides and their mixtures on the function of thyroid hormone and aryl hydrocarbon receptor in cell culture.
PubMed:Direct enantioseparation of nitrogen-heterocyclic pesticides on cellulose-based chiral column by high-performance liquid chromatography.
PubMed:Testing for cognitive function in animals in a regulatory context.
PubMed:In vitro-in vivo correlations for endocrine activity of a mixture of currently used pesticides.
PubMed:Currently used pesticides and their mixtures affect the function of sex hormone receptors and aromatase enzyme activity.
PubMed:Levels of pesticides and their metabolites in Wistar rat amniotic fluids and maternal urine upon gestational exposure.
PubMed:Kinetic aspects and identification of by-products during the ozonation of bitertanol in agricultural wastewaters.
PubMed:Determination of fungicide residues in baby food by liquid chromatography-ion trap tandem mass spectrometry.
PubMed:A high-throughput approach for the determination of pesticide residues in cucumber samples using solid-phase microextraction on 96-well plate.
PubMed:HPLC-MS/MS enantioseparation of triazole fungicides using polysaccharide-based stationary phases.
PubMed:Influence of pesticides on yeasts colonizing leaves.
PubMed:Development of a gas chromatography-mass spectrometry method for the determination of pesticides in gaseous and particulate phases in the atmosphere.
PubMed:CYP1A inhibition in fish gill filaments: a novel assay applied on pharmaceuticals and other chemicals.
PubMed:Development of a rapid determination of pesticides in coated seeds using a high-performance liquid chromatography-UV detection system.
PubMed:Desorption electrospray ionization mass spectrometry for trace analysis of agrochemicals in food.
PubMed:Determination of pesticides in water samples from the Wieprz-krzna Canal in the Leczyńsko-Włodawskie Lake District of southeastern Poland by thin-layer chromatography with diode array scanning and high-performance column liquid chromatography with diode array detection.
PubMed:Analysis of currently used pesticides in fine airborne particulate matter (PM 2.5) by pressurized liquid extraction and liquid chromatography-tandem mass spectrometry.
PubMed:Fungicide seed treatment efficacy against Microdochium nivale and M. majus in vitro and in vivo.
PubMed:Quantitative Fusarium spp. and Microdochium spp. PCR assays to evaluate seed treatments for the control of Fusarium seedling blight of wheat.
PubMed:Analyses of pesticide residues in fruit-based baby food by liquid chromatography/electrospray ionization time-of-flight mass spectrometry.
PubMed:Induction and inhibition of cytochrome P450-dependent monooxygenases of rats by fungicide bitertanol.
PubMed:Capillary electrophoresis for analyzing pesticides in fruits and vegetables using solid-phase extraction and stir-bar sorptive extraction.
PubMed:Evaluation of solid-phase extraction and stir-bar sorptive extraction for the determination of fungicide residues at low-microg kg(-1) levels in grapes by liquid chromatography-mass spectrometry.
PubMed:Determination of fungicide residues in fruits by coupled-column liquid chromatography.
PubMed:Determination of tridemorph and other fungicide residues in fruit samples by liquid chromatography-electrospray tandem mass spectrometry.
PubMed:Evaluation of a method based on liquid chromatography/electrospray tandem mass spectrometry for analyzing eight triazolic and pyrimidine fungicides in extracts of processed fruits and vegetables.
PubMed:[Inhibitory effect of zinc on beta-hexosaminidase release from RBL-2H3 cells by synthetic chemicals].
PubMed:Determination of seventeen polar/thermolabile pesticides in apples and apricots by liquid chromatography/mass spectrometry.
PubMed:Comparison of microextraction procedures to determine pesticides in oranges by liquid chromatography-mass spectrometry.
PubMed:Pesticide residues in agricultural products monitored in Hyogo Prefecture, Japan, FYs 1995-1999.
PubMed:[Effects of organonitrogen, carbamate pesticides and others on beta-hexosaminidase release from rat basophilic leukemia cells (RBL-2H3)].
PubMed:Assessment of the stability of pesticides during cryogenic sample processing. 1. Apples.
PubMed:Possible bitertanol and fuberidazole poisoning in young pheasants.
PubMed:High-performance chiral separation of fourteen triazole fungicides by sulfated beta-cyclodextrin-mediated capillary electrophoresis.
PubMed:Multiresidue determination of 19 fungicides in processed fruits and vegetables by capillary gas chromatography after gel permeation chromatography.
PubMed:Determination of bitertanol residues in strawberries by liquid chromatography with fluorescence detection and confirmation by gas chromatography/mass spectrometry.
PubMed:A novel ATP-binding cassette transporter involved in multidrug resistance in the phytopathogenic fungus Penicillium digitatum.
PubMed:Simple and rapid method for simultaneous gas chromatographic determination of bitertanol, metalaxyl, oxadixyl, propiconazole, and triadimefon residues in cucumbers.
PubMed:Bitertanol, a triazole fungicide, increases operant responding but not motor activity.
 
Notes:
None found
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