FRAXINELLONE Structure

FRAXINELLONE

Chemical Properties

Melting point 114.0 to 118.0 °C
Boiling point 314.44°C (rough estimate)
Density  1.1649 (rough estimate)
refractive index  1.5557 (estimate)
storage temp.  Keep in dark place,Sealed in dry,Store in freezer, under -20°C
solubility  Soluble in acetone and methan
form  powder to crystal
color  White to Almost white
Major Application food and beverages
InChI 1S/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3/t12-,14+/m0/s1
InChIKey XYYAFLHHHZVPRN-GXTWGEPZSA-N
SMILES CC1=C(C(O[C@H]2C3=COC=C3)=O)[C@@]2(C)CCC1
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Skull and Crossbones (GHS06)
Signal wordDanger
Hazard statements H301
Precautionary statements P501-P270-P264-P301+P310+P330-P405
Safety Statements  24/25
RIDADR  UN 2811 6.1/PG III
WGK Germany  WGK 3
RTECS  TI3767000
HazardClass  6.1
PackingGroup  III
HS Code  29321900
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Repr. 2
NFPA 704:
0
2 0

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