514209-42-8

Name 3-(4-Methylpiperazin-1-ylmethyl)benzoic acid
CAS 514209-42-8
EINECS(EC#) 604-604-1
Molecular Formula C13H18N2O2
MDL Number MFCD01202932
Molecular Weight 234.29
MOL File 514209-42-8.mol
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Chemical Properties

Boiling point  383.7±32.0 °C(Predicted)
density  1.174±0.06 g/cm3(Predicted)
storage temp.  2-8°C, protect from light
form  solid
pka 4.28±0.10(Predicted)
Appearance White to off-white Solid
InChI 1S/C13H18N2O2/c1-14-5-7-15(8-6-14)10-11-3-2-4-12(9-11)13(16)17/h2-4,9H,5-8,10H2,1H3,(H,16,17)
InChIKey SMSCFZLMSBEZQU-UHFFFAOYSA-N
SMILES O=C(O)C1=CC=CC(CN2CCN(C)CC2)=C1

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
HS Code  29339900
Storage Class 11 - Combustible Solids

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Hazard Information

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