ChemSpider 2D Image | 4,4,4-Trifluoro-2-(fluoromethyl)butanal | C5H6F4O

4,4,4-Trifluoro-2-(fluoromethyl)butanal

  • Molecular FormulaC5H6F4O
  • Average mass158.094 Da
  • Monoisotopic mass158.035477 Da
  • ChemSpider ID45456284

More details:

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

4,4,4-Trifluor-2-(fluormethyl)butanal [German] [ACD/IUPAC Name]
4,4,4-Trifluoro-2-(fluoromethyl)butanal [ACD/IUPAC Name]
4,4,4-Trifluoro-2-(fluorométhyl)butanal [French] [ACD/IUPAC Name]
Butanal, 4,4,4-trifluoro-2-(fluoromethyl)- [ACD/Index Name]
1780803-02-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 103.9±40.0 °C at 760 mmHg
Vapour Pressure: 31.5±0.2 mmHg at 25°C
Enthalpy of Vaporization: 34.3±3.0 kJ/mol
Flash Point: 30.9±21.5 °C
Index of Refraction: 1.321
Molar Refractivity: 26.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 8.28
ACD/KOC (pH 5.5): 158.02
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 8.28
ACD/KOC (pH 7.4): 158.02
Polar Surface Area: 17 Å2
Polarizability: 10.3±0.5 10-24cm3
Surface Tension: 18.4±3.0 dyne/cm
Molar Volume: 130.6±3.0 cm3

Click to predict properties on the Chemicalize site


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