ChemSpider 2D Image | 1-(2-Azaspiro[4.4]non-2-yl)-4,4,4-trifluoro-1-butanone | C12H18F3NO

1-(2-Azaspiro[4.4]non-2-yl)-4,4,4-trifluoro-1-butanone

  • Molecular FormulaC12H18F3NO
  • Average mass249.273 Da
  • Monoisotopic mass249.134048 Da
  • ChemSpider ID62749618

More details:

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

1-(2-Azaspiro[4.4]non-2-yl)-4,4,4-trifluor-1-butanon [German] [ACD/IUPAC Name]
1-(2-Azaspiro[4.4]non-2-yl)-4,4,4-trifluoro-1-butanone [ACD/IUPAC Name]
1-(2-Azaspiro[4.4]non-2-yl)-4,4,4-trifluoro-1-butanone [French] [ACD/IUPAC Name]
1-Butanone, 1-(2-azaspiro[4.4]non-2-yl)-4,4,4-trifluoro- [ACD/Index Name]
2-(4,4,4-trifluorobutanoyl)-2-azaspiro[4.4]nonane

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

Density: 1.2±0.1 g/cm3
Boiling Point: 317.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.9±3.0 kJ/mol
Flash Point: 145.7±27.9 °C
Index of Refraction: 1.466
Molar Refractivity: 57.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.93
ACD/KOC (pH 5.5): 620.24
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.93
ACD/KOC (pH 7.4): 620.24
Polar Surface Area: 20 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 33.5±5.0 dyne/cm
Molar Volume: 209.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement