Basic information Safety Related Supplier
KHELLIN Structure

KHELLIN

Chemical Properties

Melting point 150154°C
Boiling point 180200°C0.05mm Hg
Density  1.1954 (rough estimate)
refractive index  1.4560 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
form  crystalline
color  light yellow
Water Solubility  247.2g/L(25 ºC)
Merck  14,5309
BRN  263185
Major Application food and beverages
InChI 1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3
InChIKey HSMPDPBYAYSOBC-UHFFFAOYSA-N
SMILES COc1c2OC(C)=CC(=O)c2c(OC)c3ccoc13
LogP 1.770 (est)
EPA Substance Registry System Khellin (82-02-0)

Safety Information

Hazard Codes  T
Risk Statements  25-38-36/37/38-23/24/25
Safety Statements  36/37/39-45-26
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
RTECS  LV1050000
HS Code  2932.99.7000
HazardClass  6.1(b)
PackingGroup  III
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Toxicity LD50 in mice, rats (mg/kg): 30.6, 34.4 i.v.; 50.8, 68.8 orally (Busch)

MSDS

Usage And Synthesis

KHELLIN Supplier

KHELLIN manufacturers