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BUTURON Structure

BUTURON

Chemical Properties

Melting point 149℃
Boiling point 394.9±42.0 °C(Predicted)
Density  1.233
refractive index  1.6000 (estimate)
Flash point >100 °C
storage temp.  0-6°C
pka 13.69±0.70(Predicted)
Water Solubility  30mg/L(20 ºC)
BRN  2941811
Henry's Law Constant 1.3×104 mol/(m3Pa) at 25℃, MacBean (2012)
Major Application agriculture
environmental
InChI 1S/C12H13ClN2O/c1-4-9(2)15(3)12(16)14-11-7-5-10(13)6-8-11/h1,5-9H,2-3H3,(H,14,16)
InChIKey BYYMILHAKOURNM-UHFFFAOYSA-N
SMILES CC(C#C)N(C)C(=O)Nc1ccc(Cl)cc1
EPA Substance Registry System Buturon (3766-60-7)

Safety Information

Hazard Codes  Xn
Risk Statements  22
WGK Germany  3
RTECS  YS6475000
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Toxicity mouse,LD50,intraperitoneal,500mg/kg (500mg/kg),"Wirksubstanzen der Pflanzenschutz und Schadlingsbekampfungsmittel," Perkow, W., Berlin, Verlag Paul Parey, 1971-1976Vol. -, Pg. -, 1971/1976.

Usage And Synthesis

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