ChemSpider 2D Image | 3,3,5,5,6,6,6-Heptafluorohexanoic acid | C6H5F7O2

3,3,5,5,6,6,6-Heptafluorohexanoic acid

  • Molecular FormulaC6H5F7O2
  • Average mass242.092 Da
  • Monoisotopic mass242.017776 Da
  • ChemSpider ID97325176

More details:






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

3,3,5,5,6,6,6-Heptafluorhexansäure [German] [ACD/IUPAC Name]
3,3,5,5,6,6,6-Heptafluorohexanoic acid [ACD/IUPAC Name]
Acide 3,3,5,5,6,6,6-heptafluorohexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 3,3,5,5,6,6,6-heptafluoro- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 185.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.7 mmHg at 25°C
Enthalpy of Vaporization: 46.5±6.0 kJ/mol
Flash Point: 66.0±25.9 °C
Index of Refraction: 1.327
Molar Refractivity: 32.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.78
ACD/LogD (pH 7.4): -1.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 21.2±3.0 dyne/cm
Molar Volume: 160.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement