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1-(3-Methylbenzyl)piperazine Structure

1-(3-Methylbenzyl)piperazine

Chemical Properties

Melting point 110℃
Boiling point 256-257 °C(lit.)
Density  1.001 g/mL at 25 °C(lit.)
refractive index  n20/D 1.5400(lit.)
Flash point >230 °F
storage temp.  Refrigerator
solubility  DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml; Ethanol:PBS (pH 7.2)(1:2): 0.33 mg/ml
form  Oil
pka 9.18±0.10(Predicted)
color  Colourless to Pale Yellow
InChI 1S/C12H18N2/c1-11-3-2-4-12(9-11)10-14-7-5-13-6-8-14/h2-4,9,13H,5-8,10H2,1H3
InChIKey VTEOTZPEMDQENX-UHFFFAOYSA-N
SMILES Cc1cccc(CN2CCNCC2)c1
CAS DataBase Reference 5321-48-2(CAS DataBase Reference)

Safety Information

Hazard Codes  Xn,Xi
Risk Statements  22-36/37/38
Safety Statements  26-36
WGK Germany  2
RTECS  TM1400000
Hazard Note  Irritant
HS Code  29335990
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

Preparation Products And Raw materials

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