19053-94-2

Name 2-Acetyl-3,5-dihydroxyphenylacetic acid
CAS 19053-94-2
Molecular Formula C10H10O5
MDL Number MFCD24393722
Molecular Weight 210.18
MOL File 19053-94-2.mol

Chemical Properties

Boiling point  466.4±24.0 °C(Predicted)
density  1.446±0.06 g/cm3(Predicted)
storage temp.  -20°C
solubility  DMSO: soluble; Methanol: soluble
form  A solid
pka 3.96±0.10(Predicted)
Major Application metabolomics
vitamins, nutraceuticals, and natural products
InChI 1S/C10H10O5/c1-5(11)10-6(3-9(14)15)2-7(12)4-8(10)13/h2,4,12-13H,3H2,1H3,(H,14,15)
InChIKey JAHPPWGWEUVLMS-UHFFFAOYSA-N
SMILES O=C(C1=C(C=C(C=C1O)O)CC(O)=O)C

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier