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Ligustilide Structure

Ligustilide

Chemical Properties

Boiling point 377.9±11.0 °C(Predicted)
Density  1.10±0.1 g/cm3(Predicted)
storage temp.  -20°C, protect from light, stored under nitrogen
solubility  DMSO : 100 mg/mL (525.65 mM; Need ultrasonic)
form  Oil
color  Colorless to light yellow
Stability Light Sensitive
Major Application metabolomics
vitamins, nutraceuticals, and natural products
InChI InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3
InChIKey IQVQXVFMNOFTMU-UHFFFAOYSA-N
SMILES C1(=O)C2=C(CCC=C2)C(=CCCC)O1
LogP 1.710 (est)

Safety Information

Risk Statements  22/23
Safety Statements  24/25
RIDADR  2810
WGK Germany  WGK 3
HS Code  29322090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

Usage And Synthesis

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