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59-06-3

Name Ethopabate
CAS 59-06-3
EINECS(EC#) 200-414-3
Molecular Formula C12H15NO4
MDL Number MFCD00075809
Molecular Weight 237.25
MOL File 59-06-3.mol

Chemical Properties

Melting point  148-151 °C
Boiling point  426.1±35.0 °C(Predicted)
density  1.180±0.06 g/cm3(Predicted)
storage temp.  0-6°C
solubility  DMSO: 50 mg/mL (210.75 mM)
form  A solid
pka 14.12±0.70(Predicted)
Merck  13,3781
InChI InChI=1S/C12H15NO4/c1-4-17-11-7-9(13-8(2)14)5-6-10(11)12(15)16-3/h5-7H,4H2,1-3H3,(H,13,14)
InChIKey GOVWOKSKFSBNGD-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=CC=C(NC(C)=O)C=C1OCC
CAS DataBase Reference 59-06-3(CAS DataBase Reference)
EPA Substance Registry System 59-06-3(EPA Substance)

Safety Data

Hazard Codes  Xn
Risk Statements 
R22:Harmful if swallowed.
WGK Germany  3
HS Code  2924296000

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

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