ChemSpider 2D Image | 2-(1-Piperazinyl)ethyl nitrate | C6H13N3O3

2-(1-Piperazinyl)ethyl nitrate

  • Molecular FormulaC6H13N3O3
  • Average mass175.186 Da
  • Monoisotopic mass175.095688 Da
  • ChemSpider ID24215195

More details:

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

1-Piperazineethanol, nitrate (ester) [ACD/Index Name]
1-Piperazineethanol,nitrate(ester)(9CI)
2-(1-Piperazinyl)ethyl nitrate [ACD/IUPAC Name]
2-(1-Piperazinyl)ethylnitrat [German] [ACD/IUPAC Name]
52808-35-2 [RN]
Nitrate de 2-(1-pipérazinyl)éthyle [French] [ACD/IUPAC Name]
1-Piperazineethanol, nitrate (ester) (9CI)
1-Piperazineethanol,nitrate(ester)
2-(piperazin-1-yl)ethyl nitrate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 276.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.5±3.0 kJ/mol
Flash Point: 121.0±23.2 °C
Index of Refraction: 1.477
Molar Refractivity: 42.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): -2.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.07
Polar Surface Area: 70 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 150.3±3.0 cm3

Click to predict properties on the Chemicalize site


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