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alpha-Asarone Structure

alpha-Asarone

Chemical Properties

Melting point 57-61 °C(lit.)
Boiling point 296 °C(lit.)
Density  1.1227 (rough estimate)
refractive index  1.5060 (estimate)
storage temp.  Keep in dark place,Sealed in dry,2-8°C
solubility  Soluble in chloroform, methanol.
form  Solid
color  White to Off-White
Sensitive  Light Sensitive
λmax 312nm(EtOH)(lit.)
BRN  1910606
InChI InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+
InChIKey RKFAZBXYICVSKP-AATRIKPKSA-N
SMILES C1(OC)=CC(/C=C/C)=C(OC)C=C1OC
LogP 3.406 (est)
CAS DataBase Reference 2883-98-9(CAS DataBase Reference)
NIST Chemistry Reference Asarone(2883-98-9)

Safety Information

Hazard Codes  Xn
Risk Statements  22
Safety Statements  22-24/25
WGK Germany  3
RTECS  DC2975000
HS Code  29093090
Storage Class 13 - Non Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Hazardous Substances Data 2883-98-9(Hazardous Substances Data)
Toxicity bird - wild,LD50,oral,750mg/kg (750mg/kg),Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.

MSDS

Usage And Synthesis

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