ChemSpider 2D Image | 2,2,3,3,3-Pentafluoro-1-(4-isobutylphenyl)-1-propanone | C13H13F5O

2,2,3,3,3-Pentafluoro-1-(4-isobutylphenyl)-1-propanone

  • Molecular FormulaC13H13F5O
  • Average mass280.234 Da
  • Monoisotopic mass280.088654 Da
  • ChemSpider ID35327329

More details:

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

1-Propanone, 2,2,3,3,3-pentafluoro-1-[4-(2-methylpropyl)phenyl]- [ACD/Index Name]
2,2,3,3,3-Pentafluor-1-(4-isobutylphenyl)-1-propanon [German] [ACD/IUPAC Name]
2,2,3,3,3-Pentafluoro-1-(4-isobutylphenyl)-1-propanone [ACD/IUPAC Name]
2,2,3,3,3-Pentafluoro-1-(4-isobutylphényl)-1-propanone [French] [ACD/IUPAC Name]
1443313-27-6 [RN]
4'-iso-Butyl-2,2,3,3,3-pentafluoropropiophenone
atoms 19 bonds 19
MFCD15145686

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

Density: 1.2±0.1 g/cm3
Boiling Point: 263.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.1±3.0 kJ/mol
Flash Point: 100.6±21.5 °C
Index of Refraction: 1.436
Molar Refractivity: 60.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1731.45
ACD/KOC (pH 5.5): 7238.54
ACD/LogD (pH 7.4): 4.56
ACD/BCF (pH 7.4): 1731.45
ACD/KOC (pH 7.4): 7238.54
Polar Surface Area: 17 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 26.4±3.0 dyne/cm
Molar Volume: 231.0±3.0 cm3

Click to predict properties on the Chemicalize site


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