ChemSpider 2D Image | (2R)-1,1,1,4,4,4-Hexafluoro-2-butanol | C4H4F6O

(2R)-1,1,1,4,4,4-Hexafluoro-2-butanol

  • Molecular FormulaC4H4F6O
  • Average mass182.064 Da
  • Monoisotopic mass182.016632 Da
  • ChemSpider ID65748769

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1,1,1,4,4,4-Hexafluor-2-butanol [German] [ACD/IUPAC Name]
(2R)-1,1,1,4,4,4-Hexafluoro-2-butanol [ACD/IUPAC Name]
(2R)-1,1,1,4,4,4-Hexafluoro-2-butanol [French] [ACD/IUPAC Name]
2-Butanol, 1,1,1,4,4,4-hexafluoro-, (2R)- [ACD/Index Name]
(2R)-1,1,1,4,4,4-hexafluorobutan-2-ol
2227881-21-0 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 126.2±35.0 °C at 760 mmHg
Vapour Pressure: 5.4±0.5 mmHg at 25°C
Enthalpy of Vaporization: 42.4±6.0 kJ/mol
Flash Point: 30.1±25.9 °C
Index of Refraction: 1.294
Molar Refractivity: 23.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 5.94
ACD/KOC (pH 5.5): 124.62
ACD/LogD (pH 7.4): 1.32
ACD/BCF (pH 7.4): 5.94
ACD/KOC (pH 7.4): 124.61
Polar Surface Area: 20 Å2
Polarizability: 9.1±0.5 10-24cm3
Surface Tension: 16.6±3.0 dyne/cm
Molar Volume: 125.2±3.0 cm3

Click to predict properties on the Chemicalize site


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