487-11-6

Name Elemicin
CAS 487-11-6
EINECS(EC#) 207-649-0
Molecular Formula C12H16O3
MDL Number MFCD01656688
Molecular Weight 208.25
MOL File 487-11-6.mol

Chemical Properties

Boiling point  152-156 °C
density  1.0630 g/cm3
storage temp.  Amber Vial, -20°C Freezer
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly)
form  Oil
color  Colourless
Odor at 100.00 %. spice flower
Odor Type spicy
Stability: Light Sensitive
Major Application food and beverages
pharmaceutical
InChI InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5,7-8H,1,6H2,2-4H3
InChIKey BPLQKQKXWHCZSS-UHFFFAOYSA-N
SMILES C1(OC)=CC(CC=C)=CC(OC)=C1OC
LogP 2.298 (est)
NIST Chemistry Reference Benzene, 1,2,3-trimethoxy-5-(2-propenyl)-(487-11-6)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338
WGK Germany  WGK 3
HS Code  2909309090
Storage Class 10 - Combustible liquids

Hazard Information

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