ChemSpider 2D Image | 4,4,4-Trifluoro-1-(1-piperazinyl)-1-butanone | C8H13F3N2O

4,4,4-Trifluoro-1-(1-piperazinyl)-1-butanone

  • Molecular FormulaC8H13F3N2O
  • Average mass210.197 Da
  • Monoisotopic mass210.097992 Da
  • ChemSpider ID27456281

More details:

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

1-Butanone, 4,4,4-trifluoro-1-(1-piperazinyl)- [ACD/Index Name]
4,4,4-Trifluor-1-(1-piperazinyl)-1-butanon [German] [ACD/IUPAC Name]
4,4,4-Trifluoro-1-(1-piperazinyl)-1-butanone [ACD/IUPAC Name]
4,4,4-Trifluoro-1-(1-pipérazinyl)-1-butanone [French] [ACD/IUPAC Name]
1-(4,4,4-trifluorobutanoyl)piperazine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 273.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.2±3.0 kJ/mol
Flash Point: 119.1±27.3 °C
Index of Refraction: 1.422
Molar Refractivity: 44.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.41
ACD/LogD (pH 5.5): -1.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.58
Polar Surface Area: 32 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 29.0±3.0 dyne/cm
Molar Volume: 174.2±3.0 cm3

Click to predict properties on the Chemicalize site


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