ChemSpider 2D Image | (4S)-3,3,4,5,5,5-Hexafluoro-2-methyl-2-pentanol | C6H8F6O

(4S)-3,3,4,5,5,5-Hexafluoro-2-methyl-2-pentanol

  • Molecular FormulaC6H8F6O
  • Average mass210.117 Da
  • Monoisotopic mass210.047928 Da
  • ChemSpider ID97477435

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-3,3,4,5,5,5-Hexafluor-2-methyl-2-pentanol [German] [ACD/IUPAC Name]
(4S)-3,3,4,5,5,5-Hexafluoro-2-methyl-2-pentanol [ACD/IUPAC Name]
(4S)-3,3,4,5,5,5-Hexafluoro-2-méthyl-2-pentanol [French] [ACD/IUPAC Name]
2-Pentanol, 3,3,4,5,5,5-hexafluoro-2-methyl-, (4S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 126.8±35.0 °C at 760 mmHg
Vapour Pressure: 5.3±0.5 mmHg at 25°C
Enthalpy of Vaporization: 42.5±6.0 kJ/mol
Flash Point: 30.5±25.9 °C
Index of Refraction: 1.329
Molar Refractivity: 32.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 12.15
ACD/KOC (pH 5.5): 207.90
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 12.15
ACD/KOC (pH 7.4): 207.90
Polar Surface Area: 20 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 18.3±3.0 dyne/cm
Molar Volume: 158.3±3.0 cm3

Click to predict properties on the Chemicalize site


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