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isoxaflutole
methanone, (5-cyclopropyl-4-isoxazolyl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]-

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Name:(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone
CAS Number: 141112-29-0Picture of molecule3D/inchi
FDA UNII: 0T9R0O0EYT
Nikkaji Web:J794.343A
MDL:MFCD03095707
XlogP3-AA:2.40 (est)
Molecular Weight:359.32464960
Formula:C15 H12 F3 N O4 S
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:herbicides / pesticides
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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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
Melting Point: 140.00 °C. @ 760.00 mm Hg
Boiling Point: 575.06 °C. @ 760.00 mm Hg (est)
Vapor Pressure:7.500000 mmHg @ 25.00 °C. (est)
Flash Point: 575.00 °F. TCC ( 301.60 °C. ) (est)
logP (o/w): 2.320
Soluble in:
 water, 56.8 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
ISOXAFLUTOLE
Santa Cruz Biotechnology
For experimental / research use only.
isoXaflutole
Sigma-Aldrich
For experimental / research use only.
isoXaflutole 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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
herbicides / pesticides
Recommendation for isoxaflutole usage levels up to:
 not for fragrance use.
 
Recommendation for isoxaflutole flavor usage levels up to:
 not for flavor use.
 
Safety References:
European Food Safety Authority (EFSA) reference(s):

Reasoned opinion on the review of the existing maximum residue levels (MRLs) for isoxaflutole according to Article 12 of Regulation (EC) No 396/2005
View page or View pdf

Peer review of the pesticide risk assessment of the active substance isoxaflutole
View page or View pdf

Protocol for the evaluation of data concerning the necessity of the application of herbicide active substances to control a serious danger to plant health which cannot be contained by other available means, including non-chemical methods
View page or View pdf

Peer review of the pesticide risk assessment for the active substance isoxaflutole in light of negligible exposure data submitted
View page or View pdf

Evaluation of data concerning the necessity of isoxaflutole as a herbicide to control a serious danger to plant health which cannot be contained by other available means, including non-chemical methods
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 :84098
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone
Chemidplus:0141112290
 
References:
 (5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):84098
Pubchem (sid):135040640
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
ChemSpider:View
Formulations/Preparations:
•trade names: balance, balancepro •water dispersible granules •technical is about 98% pure. •tradenames: merlin; alliance; converge; provence. mixtures: acajou (+aclonifen); atoll (+atrazine); lagon (+aclonifen); cadou star (+flufenacet); epic (+flufenacet). •formulation type: water dispersible granule; guarantee: 75% isoxaflutole. converge 75 wdg herbicide from table
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone
(5-cyclopropyl-1,2-oxazol-4-yl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]methanone
5-cyclopropyl-4-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]isoxazole
(5-cyclopropyl-4-isoxazolyl)(2-(methylsulfonyl)-4-(trifluoromethyl)phenyl)methanone
(5-cyclopropyl-4-isoxazolyl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]methanone
(5-cyclopropylisoxazol-4-yl)(2-(methylsulfonyl)-4-(trifluoromethyl)phenyl)methanone
(5-cyclopropylisoxazol-4-yl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]methanone
4-(2-methanesulphonyl-4-trifluoromethylbenzoyl)-5-cyclopropyl isoxazole
 methanone, (5-cyclopropyl-4-isoxazolyl)(2-(methylsulfonyl)-4-(trifluoromethyl)phenyl)-
 methanone, (5-cyclopropyl-4-isoxazolyl)[2-(methylsulfonyl)-4-(trifluoromethyl)phenyl]-
 

Articles:

PubMed:Effect of buffer strips and soil texture on runoff losses of flufenacet and isoxaflutole from maize fields.
PubMed:Water pressure head and temperature impact on isoxaflutole degradation in crop residues and loamy surface soil under conventional and conservation tillage management.
PubMed:Variability of retention process of isoxaflutole and its diketonitrile metabolite in soil under conventional and conservation tillage.
PubMed:Sensitivity of locally naturalized Panicum species to HPPD- and ALS-inhibiting herbicides in maize.
PubMed:Adsorption of isoxaflutole degradates to aluminum and iron hydrous oxides.
PubMed:Investigation of endogenous soybean food allergens by using a 2-dimensional gel electrophoresis approach.
PubMed:Bioavailability of diuron, imazapic and isoxaflutole in soils of contrasting textures.
PubMed:[Screening method of pesticides in meat using cleanup with GPC and mini-column].
PubMed:Role of sorption and degradation in the herbicidal function of isoxaflutole.
PubMed:Temperature and water pressure head effects on the degradation of the diketonitrile metabolite of isoxaflutole in a loamy soil under two tillage systems.
PubMed:Comparison of fate and transport of isoxaflutole to atrazine and metolachlor in 10 Iowa rivers.
PubMed:Processes affecting the dissipation of the herbicide isoxaflutole and its diketonitrile metabolite in agricultural soils under field conditions.
PubMed:Influence of rainfall distribution on simulations of atrazine, metolachlor, and isoxaflutole/metabolite transport in subsurface drained fields.
PubMed:Improved HPLC-MS/MS method for determination of isoxaflutole (balance) and its metabolites in soils and forage plants.
PubMed:Development and validation of a multi-residue method for pesticide determination in honey using on-column liquid-liquid extraction and liquid chromatography-tandem mass spectrometry.
PubMed:Differential response of chickpea genotypes to isoxaflutole.
PubMed:Influence of an adjuvant on the distribution of herbicides in a sediment/water system.
PubMed:Reaction pathways of the diketonitrile degradate of isoxaflutole with hypochlorite in water.
PubMed:Sorption of isoxaflutole diketonitrile degradate (DKN) and dicamba in unsaturated soil.
PubMed:Characterization of fate and transport of isoxaflutole, a soil-applied corn herbicide, in surface water using a watershed model.
PubMed:Effect of soil properties on the degradation of isoxaflutole and the sorption-desorption of isoxaflutole and its diketonitrile degradate.
PubMed:Population dynamics of Digitaria spp submitted to selection pressure by herbicides in sugarcane crop.
PubMed:Degradation of RPA 202248 [U-14C-phenyl]alpha(-(cyclopropylcarbonyl)-2-(methylsulfonyl)-beta-oxo-4-(trifluromethyl)benzenepropanenitrile), the primary degradation product of isoxaflutole, in an outdoor aquatic microcosm system.
PubMed:Interrelationship of macropores and subsurface drainage for conservative tracer and pesticide transport.
PubMed:Reversal of the inhibition of photosynthesis by herbicides affecting hydroxyphenylpyruvate dioxygenase by plastoquinone and tocopheryl derivatives in Chlamydomonas reinhardtii.
PubMed:Sorption and desorption of the diketonitrile metabolite of isoxaflutole in soils.
PubMed:Degradation of isoxaflutole (balance) herbicide by hypochlorite in tap water.
PubMed:The effect of five forage species on transport and transformation of atrazine and isoxaflutole (balance) in lysimeter leachate.
PubMed:Soil persistence of 4-HPPD-inhibitors in different soil types.
PubMed:Fate of isoxaflutole in soil under controlled conditions.
PubMed:Fate of the herbicide isoxaflutole in the soil of corn fields.
PubMed:Determination of isoxaflutole (balance) and its metabolites in water using solid phase extraction followed by high-performance liquid chromatography with ultraviolet or mass spectrometry.
PubMed:Effects of moisture, temperature, and biological activity on the degradation of isoxaflutole in soil.
PubMed:Soil metabolism of isoxaflutole in corn.
PubMed:Kinetics of chemical degradation of isoxaflutole: influence of the nature of aqueous buffers (alkanoic acid/sodium salt vs phosphate).
PubMed:Isoxaflutole: the background to its discovery and the basis of its herbicidal properties.
PubMed:Cleavage of the diketonitrile derivative of the herbicide isoxaflutole by extracellular fungal oxidases.
PubMed:Kinetics of abiotic hydrolysis of isoxaflutole: influence of pH and temperature in aqueous mineral buffered solutions.
PubMed:Inhibition of p-hydroxyphenylpyruvate dioxygenase by the diketonitrile of isoxaflutole: a case of half-site reactivity.
PubMed:Spectroscopic study of the sorption of isoxaflutole and its diketonitrile metabolite in dissimilar soils.
 
Notes:
None found
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