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Clodinafop-propargyl  Structure

Clodinafop-propargyl

Chemical Properties

Melting point 48-57°C
alpha  D20 +45.4° (c = 2 in acetone)
Boiling point 432.7±45.0 °C(Predicted)
Density  1.37 g/cm3(Temp: 22 °C)
storage temp.  0-6°C
solubility  DMSO: 100 mg/mL (285.93 mM)
form  Solid
pka -1.54±0.32(Predicted)
color  Off-white to yellow
BRN  8857008
Major Application agriculture
environmental
InChI InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1
InChIKey JBDHZKLJNAIJNC-LLVKDONJSA-N
SMILES C(OCC#C)(=O)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C
CAS DataBase Reference 105512-06-9(CAS DataBase Reference)
EPA Substance Registry System Propanoic acid, 2-[4-[(5-chloro-3-fluoro-2-pyridinyl)oxy]phenoxy]-, 2-propynyl ester, (2R)- (105512-06-9)

Safety Information

Hazard Codes  Xn;N,N,Xn
Risk Statements  20/22-43-50/53-48/22
Safety Statements  36/37-60-61-46-24
RIDADR  UN 2811
WGK Germany  3
HS Code  29333990
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Skin Sens. 1
STOT RE 2
Hazardous Substances Data 105512-06-9(Hazardous Substances Data)
Toxicity LD50 in rats (mg/kg): 1829 orally; >2000 dermally; LC50 in rats (4 hr): >2325 mg/m3 by inhalation (Amrein)

MSDS

Usage And Synthesis

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