81335-77-5

Name Imazethapyr
CAS 81335-77-5
Molecular Formula C15H19N3O3
MDL Number MFCD00274561
Molecular Weight 289.33
MOL File 81335-77-5.mol

Chemical Properties

Melting point  169-173°C
Boiling point  431.49°C (rough estimate)
density  1.1302 (rough estimate)
refractive index  1.5600 (estimate)
storage temp.  0-6°C
solubility  DMSO: 83.33 mg/mL (288.01 mM)
form  neat
pka pK1 2.1; pK2 3.9(at 25℃)
color  White to light yellow
BRN  7437150
Henry's Law Constant 9.9×1010 mol/(m3Pa) at 25℃, HSDB (2015)
Major Application agriculture
environmental
InChI 1S/C15H19N3O3/c1-5-9-6-10(13(19)20)11(16-7-9)12-17-14(21)15(4,18-12)8(2)3/h6-8H,5H2,1-4H3,(H,19,20)(H,17,18,21)
InChIKey XVOKUMIPKHGGTN-UHFFFAOYSA-N
SMILES CCc1cnc(C2=NC(C)(C(C)C)C(=O)N2)c(c1)C(O)=O
CAS DataBase Reference 81335-77-5(CAS DataBase Reference)
EPA Substance Registry System Imazethapyr (81335-77-5)

Safety Data

WGK Germany  1
RTECS  US5682900
REACH Registrations Active
HS Code  29333990
Storage Class 11 - Combustible Solids
Hazardous Substances Data 81335-77-5(Hazardous Substances Data)
Toxicity
LD50 orally in rats and mice: >5000 mg/kg; dermally in rabbits: >2000 mg/kg (Peoples)

Hazard Information

Material Safety Data Sheet(MSDS)

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