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54256-45-0

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Basic Information
CAS No.: 54256-45-0
Name: 1-OCTYLPIPERAZINE
Article Data: 8
Molecular Structure:
Molecular Structure of 54256-45-0 (1-OCTYLPIPERAZINE)
Formula: C12H26 N2
Molecular Weight: 198.352
Synonyms: 1-Octylpiperazine;N-Octylpiperazine
Density: 0.836 g/mL at 25 °C(lit.)
Boiling Point: 273.6 °C at 760 mmHg
Flash Point: 88 °C
Solubility: at 25 deg C (mg/L): 1673
Hazard Symbols: Xi
Risk Codes: 10-36/37/38
Safety: 26
Transport Information: UN 1993 3
PSA: 15.27000
LogP: 2.51880
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Chemistry

Molecular Structure of 1-Octylpiperazinato (CAS NO.54256-45-0):

IUPAC Name: 1-octylpiperazine 
Empirical Formula: C12H26N2
Molecular Weight: 198.3482
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 15.27Å2
Index of Refraction: 1.455
Molar Refractivity: 62.485 cm3
Molar Volume: 230.163 cm3
Surface Tension: 29.35 dyne/cm
Density: 0.862 g/cm3
Flash Point: 87.963 °C
Enthalpy of Vaporization: 51.193 kJ/mol
Boiling Point: 273.582 °C at 760 mmHg
Vapour Pressure: 0.006 mmHg at 25°C
SMILES: CCCCCCCCN1CCNCC1
InChI: InChI=1/C12H26N2/c1-2-3-4-5-6-7-10-14-11-8-13-9-12-14/h13H,2-12H2,1H3
Product Categories: Building Blocks; Heterocyclic Building Blocks; Piperazines

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 10-36/37/38
R10:Flammable. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
RIDADR: UN 1993 3/PG 3
WGK Germany: 3
Hazard Note: Irritant

Specification

  1-Octylpiperazinato , with CAS number of 54256-45-0, can be called piperazine, 1-octyl- ; 1-Octylpiperazine ; 1-(n-Octyl)piperazine 97% ; 1-(1-Octyl)-piperazine .