486-21-5

Name Isofraxidin
CAS 486-21-5
Molecular Formula C11H10O5
MDL Number MFCD00221757
Molecular Weight 222.19
MOL File 486-21-5.mol
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Chemical Properties

Melting point  145～147℃
Boiling point  452.1±45.0 °C(Predicted)
density  1.358±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: 250 mg/mL (1125.16 mM)
form  neat
pka 7.92±0.20(Predicted)
color  Yellow to brown
BRN  202652
InChI InChI=1S/C11H10O5/c1-14-7-5-6-3-4-8(12)16-10(6)11(15-2)9(7)13/h3-5,13H,1-2H3
InChIKey HOEVRHHMDJKUMZ-UHFFFAOYSA-N
SMILES C1(=O)OC2=C(OC)C(O)=C(OC)C=C2C=C1
CAS DataBase Reference 486-21-5(CAS DataBase Reference)

Safety Data

Safety Statements 
WGK Germany  3
HS Code  29322090
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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