ChemSpider 2D Image | 3-[3-(Difluoromethoxy)-1,1,2,2,3,3-hexafluoropropoxy]-2,2,3,3-tetrafluoropropanoic acid | C7H2F12O4

3-[3-(Difluoromethoxy)-1,1,2,2,3,3-hexafluoropropoxy]-2,2,3,3-tetrafluoropropanoic acid

  • Molecular FormulaC7H2F12O4
  • Average mass378.069 Da
  • Monoisotopic mass377.976135 Da
  • ChemSpider ID58539794

More details:

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

3-[3-(Difluormethoxy)-1,1,2,2,3,3-hexafluorpropoxy]-2,2,3,3-tetrafluorpropansäure [German] [ACD/IUPAC Name]
3-[3-(Difluoromethoxy)-1,1,2,2,3,3-hexafluoropropoxy]-2,2,3,3-tetrafluoropropanoic acid [ACD/IUPAC Name]
Acide 3-[3-(difluorométhoxy)-1,1,2,2,3,3-hexafluoropropoxy]-2,2,3,3-tétrafluoropropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[3-(difluoromethoxy)-1,1,2,2,3,3-hexafluoropropoxy]-2,2,3,3-tetrafluoro- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 239.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 52.5±6.0 kJ/mol
Flash Point: 98.7±27.3 °C
Index of Refraction: 1.305
Molar Refractivity: 41.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 9.15
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 2.39
ACD/KOC (pH 5.5): 5.70
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 2.23
ACD/KOC (pH 7.4): 5.32
Polar Surface Area: 56 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 19.8±3.0 dyne/cm
Molar Volume: 217.4±3.0 cm3

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