ChemSpider 2D Image | 2-Methoxy-1-{4-[(1-propyl-1H-tetrazol-5-yl)methyl]-1-piperazinyl}ethanone | C12H22N6O2

2-Methoxy-1-{4-[(1-propyl-1H-tetrazol-5-yl)methyl]-1-piperazinyl}ethanone

  • Molecular FormulaC12H22N6O2
  • Average mass282.342 Da
  • Monoisotopic mass282.180420 Da
  • ChemSpider ID26081865

More details:






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

2-Methoxy-1-{4-[(1-propyl-1H-tetrazol-5-yl)methyl]-1-piperazinyl}ethanon [German] [ACD/IUPAC Name]
2-Methoxy-1-{4-[(1-propyl-1H-tetrazol-5-yl)methyl]-1-piperazinyl}ethanone [ACD/IUPAC Name]
2-Méthoxy-1-{4-[(1-propyl-1H-tétrazol-5-yl)méthyl]-1-pipérazinyl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-methoxy-1-[4-[(1-propyl-1H-tetrazol-5-yl)methyl]-1-piperazinyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 496.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 254.1±28.7 °C
Index of Refraction: 1.613
Molar Refractivity: 75.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.50
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.56
Polar Surface Area: 76 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 217.4±7.0 cm3

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