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Flumetralin Structure

Flumetralin

Chemical Properties

Melting point 102 °C
Boiling point 223.5°C (rough estimate)
Density  1.5019 (estimate)
Flash point >100 °C
storage temp.  2-8°C
solubility  Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
pka -2.63±0.50(Predicted)
form  Solid
color  Yellow to Dark Orange
Henry's Law Constant 5.2×100 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
Major Application agriculture
environmental
InChI InChI=1S/C16H12ClF4N3O4/c1-2-22(8-10-11(17)4-3-5-12(10)18)15-13(23(25)26)6-9(16(19,20)21)7-14(15)24(27)28/h3-7H,2,8H2,1H3
InChIKey PWNAWOCHVWERAR-UHFFFAOYSA-N
SMILES C1(CN(C2=C([N+]([O-])=O)C=C(C(F)(F)F)C=C2[N+]([O-])=O)CC)=C(F)C=CC=C1Cl
LogP 5.450
CAS DataBase Reference 62924-70-3(CAS DataBase Reference)
NIST Chemistry Reference Benzenemethanamine, 2-chloro-n-(2,6-dinitro-4-(trifluoromethyl)phenyl)-n-ethyl-6-fluoro-(62924-70-3)
EPA Substance Registry System Flumetralin (62924-70-3)

Safety Information

Hazard Codes  Xi,N,F
Risk Statements  36/38-43-50/53-67-66-36-11
Safety Statements  36/37-60-61-26-16-9
RIDADR  UN 1090 3/PG 2
WGK Germany  WGK 2
RTECS  DA4391600
HS Code  29214300
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Acute 1
Aquatic Chronic 1
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1

MSDS

Usage And Synthesis

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