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Isoxaflutole information


Isoxaflutol
Names
IUPAC name
(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone
Other names
  • RPA201772
Identifiers
CAS Number
  • 141112-29-0 checkY
3D model (JSmol)
  • Interactive image
Beilstein Reference
8344543
ChEBI
  • CHEBI:141213 checkY
ChEMBL
  • ChEMBL1887147
ChemSpider
  • 75869 checkY
DrugBank
  • DB12938 checkY
ECHA InfoCard 100.114.433 Edit this at Wikidata
EC Number
  • 604-222-4
PubChem CID
  • 84098
UNII
  • 0T9R0O0EYT
CompTox Dashboard (EPA)
  • DTXSID5034723 Edit this at Wikidata
InChI
  • InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3 checkY
    Key: OYIKARCXOQLFHF-UHFFFAOYSA-N checkY
SMILES
  • CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3
Properties[1]
Chemical formula
C15H12F3NO4S
Molar mass 359.32 g·mol−1
Appearance Off-white or pale yellow solid
Density 1.59 g/cm3
Melting point 138 °C (280 °F; 411 K)
Solubility in water
6.2 mg/L
log P 2.32
Hazards
GHS labelling:
Pictograms
GHS08: Health hazard GHS09: Environmental hazard
Signal word
Warning
Hazard statements
H361d, H410
Precautionary statements
P203, P273, P280, P318, P391, P405, P501
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references

Isoxaflutole is a selective herbicide used mainly in maize crops.[1] It inhibits the enzyme 4-hydroxyphenylpyruvate dioxygenase (HPPD)[2] and is sold under brand names including Balance and Merlin. It was first marketed by Rhône-Poulenc in 1996.

  1. ^ a b Pesticide Properties Database. "Isoxaflutole". University of Hertfordshire.
  2. ^ Moran, GR (Jan 2005). "4-Hydroxyphenylpyruvate dioxygenase" (PDF). Archives of Biochemistry and Biophysics. 433 (1): 117–28. doi:10.1016/j.abb.2004.08.015. PMID 15581571. Archived from the original (PDF) on 2014-03-03.

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