L-KAWAIN Structure

L-KAWAIN

Chemical Properties

Melting point 142-148℃
alpha  D20 +105° (abs alc)
Boiling point bp0.1 195-197°
Density  1.1914 (rough estimate)
refractive index  1.5557 (estimate)
storage temp.  Amber Vial, -20°C Freezer, Under inert atmosphere
solubility  Chloroform (Slightly), Ethanol (Slightly, Sonicated), Methanol (Slightly)
form  Solid
color  White to Light Yellow
Stability Light Sensitive
Major Application pharmaceutical
pharmaceutical (small molecule)
InChI InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+/t12-/m0/s1
InChIKey XEAQIWGXBXCYFX-GUOLPTJISA-N
SMILES C1(=O)O[C@@H](/C=C/C2=CC=CC=C2)CC(OC)=C1
LogP 0.784 (est)
EWG's Food Scores 1
FDA UNII W1ES06373M
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard Codes  Xn
Risk Statements  22
WGK Germany  WGK 3
HS Code  2932202000
Storage Class 11 - Combustible Solids

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L-KAWAIN Chemical Properties,Usage,Production

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