ChemSpider 2D Image | (2E)-6,6,7,7,8,8,8-Heptafluoro-4,4-bis(trifluoromethyl)-2-octenoic acid | C10H5F13O2

(2E)-6,6,7,7,8,8,8-Heptafluoro-4,4-bis(trifluoromethyl)-2-octenoic acid

  • Molecular FormulaC10H5F13O2
  • Average mass404.125 Da
  • Monoisotopic mass404.008209 Da
  • ChemSpider ID58804588

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-6,6,7,7,8,8,8-Heptafluor-4,4-bis(trifluormethyl)-2-octensäure [German] [ACD/IUPAC Name]
(2E)-6,6,7,7,8,8,8-Heptafluoro-4,4-bis(trifluoromethyl)-2-octenoic acid [ACD/IUPAC Name]
2-Octenoic acid, 6,6,7,7,8,8,8-heptafluoro-4,4-bis(trifluoromethyl)-, (2E)- [ACD/Index Name]
Acide (2E)-6,6,7,7,8,8,8-heptafluoro-4,4-bis(trifluorométhyl)-2-octénoïque [French] [ACD/IUPAC Name]
4,4-Bis(Trifluoromethyl)-2H,3H-Heptafluorohept-2-Enoic Acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 210.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.9 mmHg at 25°C
Enthalpy of Vaporization: 49.2±6.0 kJ/mol
Flash Point: 81.1±27.3 °C
Index of Refraction: 1.332
Molar Refractivity: 51.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 39.72
ACD/KOC (pH 5.5): 160.16
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.45
Polar Surface Area: 37 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 19.7±3.0 dyne/cm
Molar Volume: 253.0±3.0 cm3

Click to predict properties on the Chemicalize site


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