ChemSpider 2D Image | 1,1,1,5,5,5-Hexafluoroacetylacetone | C5H2F6O2

1,1,1,5,5,5-Hexafluoroacetylacetone

  • Molecular FormulaC5H2F6O2
  • Average mass208.059 Da
  • Monoisotopic mass207.995895 Da
  • ChemSpider ID21106446

More details:



Featured data source



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

1,1,1,5,5,5-Hexafluor-2,4-pentandion [German] [ACD/IUPAC Name]
1,1,1,5,5,5-Hexafluoro-2,4-pentadione
1,1,1,5,5,5-Hexafluoro-2,4-pentanedione [ACD/IUPAC Name]
1,1,1,5,5,5-Hexafluoro-2,4-pentanedione [French] [ACD/IUPAC Name]
1,1,1,5,5,5-Hexafluoroacetylacetone
1,1,1,5,5,5-hexafluoropentan-2,4-dione
1,1,1,5,5,5-hexafluoropentane-2,4-dione
2,4-Pentanedione, 1,1,1,5,5,5-hexafluoro- [ACD/Index Name]
1,1,1,5,5,5-Hexafluoro-2,4-pentanedione; HFAA
1,1,1,5,5,5-Hexafluoropentane-2,4-dione [HFAA]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

238309_ALDRICH [DBID]
52503_FLUKA [DBID]
MFCD00000426 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 70.0±0.0 °C at 760 mmHg
Vapour Pressure: 131.2±0.1 mmHg at 25°C
Enthalpy of Vaporization: 31.2±3.0 kJ/mol
Flash Point: 30.8±20.1 °C
Index of Refraction: 1.305
Molar Refractivity: 26.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 2.60
ACD/KOC (pH 5.5): 31.37
ACD/LogD (pH 7.4): 0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.99
Polar Surface Area: 34 Å2
Polarizability: 10.4±0.5 10-24cm3
Surface Tension: 19.0±3.0 dyne/cm
Molar Volume: 138.1±3.0 cm3

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