demethylwedelolactone Structure

demethylwedelolactone

Chemical Properties

Melting point >360 °C
Boiling point 531.4±35.0 °C(Predicted)
Density  1.827±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
form  powder
pka 7.07±0.20(Predicted)
color  Yellow
InChI InChI=1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H
InChIKey LUTYTNLPIUCKBJ-UHFFFAOYSA-N
SMILES C1(=O)OC2=CC(O)=CC(O)=C2C2OC3=CC(O)=C(O)C=C3C1=2
FDA UNII UXN2KXV8BB
UNSPSC Code 12352200
NACRES NA.77

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P270-P301+P312-P330-P501
NFPA 704:
0
2 0

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demethylwedelolactone Spectrum