ChemSpider 2D Image | 3-Amino-2-{4-[2-(dimethylamino)ethyl]-1-piperazinyl}-1-butanol | C12H28N4O

3-Amino-2-{4-[2-(dimethylamino)ethyl]-1-piperazinyl}-1-butanol

  • Molecular FormulaC12H28N4O
  • Average mass244.377 Da
  • Monoisotopic mass244.226318 Da
  • ChemSpider ID45797855

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-Piperazineethanol, β-(1-aminoethyl)-4-[2-(dimethylamino)ethyl]- [ACD/Index Name]
3-Amino-2-{4-[2-(dimethylamino)ethyl]-1-piperazinyl}-1-butanol [German] [ACD/IUPAC Name]
3-Amino-2-{4-[2-(dimethylamino)ethyl]-1-piperazinyl}-1-butanol [ACD/IUPAC Name]
3-Amino-2-{4-[2-(diméthylamino)éthyl]-1-pipérazinyl}-1-butanol [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 363.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.5±6.0 kJ/mol
Flash Point: 173.3±27.9 °C
Index of Refraction: 1.516
Molar Refractivity: 71.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -5.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 28.3±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 236.6±3.0 cm3

Click to predict properties on the Chemicalize site


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