491-64-5

Name isogentisin
CAS 491-64-5
Molecular Formula C14H10O5
MDL Number MFCD00210570
Molecular Weight 258.23
MOL File 491-64-5.mol
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Chemical Properties

Melting point  241 °C
Boiling point  519.4±39.0 °C(Predicted)
density  1.480±0.06 g/cm3(Predicted)
storage temp.  2-8°C, stored under nitrogen
form  Solid
pka 6.92±0.20(Predicted)
Appearance Light yellow to yellow Solid
Major Application food and beverages
InChI 1S/C14H10O5/c1-18-8-2-3-11-9(6-8)14(17)13-10(16)4-7(15)5-12(13)19-11/h2-6,15-16H,1H3
InChIKey FVIYCYAHKMJVJK-UHFFFAOYSA-N
SMILES [o]1c2c([c](c3c1ccc(c3)OC)=O)c(cc(c2)O)O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

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