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4-(Piperazin-1-yl)-benzoic acid ethyl ester Structure

4-(Piperazin-1-yl)-benzoic acid ethyl ester

Chemical Properties

Melting point 102-105°C
Boiling point 388.9±27.0 °C(Predicted)
Density  1.104±0.06 g/cm3(Predicted)
storage temp.  Storage temp. 2-8°C
solubility  Chloroform, DMSO, Methanol
form  Solid
pka 8.82±0.10(Predicted)
color  Pale Yellow
InChI InChI=1S/C13H18N2O2/c1-2-17-13(16)11-3-5-12(6-4-11)15-9-7-14-8-10-15/h3-6,14H,2,7-10H2,1H3
InChIKey OQEHTFFLOHTFSB-UHFFFAOYSA-N
SMILES C(OCC)(=O)C1=CC=C(N2CCNCC2)C=C1

Safety Information

Hazard Codes  Xi,Xn
Risk Statements  22
Hazard Note  Irritant
HS Code  2933599590
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Usage And Synthesis

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