ChemSpider 2D Image | (3S)-3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)-1-pentene | C6H3F9

(3S)-3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)-1-pentene

  • Molecular FormulaC6H3F9
  • Average mass246.074 Da
  • Monoisotopic mass246.009109 Da
  • ChemSpider ID114100992

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3,4,4,5,5,5-Hexafluor-3-(trifluormethyl)-1-penten [German] [ACD/IUPAC Name]
(3S)-3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)-1-pentene [ACD/IUPAC Name]
(3S)-3,4,4,5,5,5-Hexafluoro-3-(trifluorométhyl)-1-pentène [French] [ACD/IUPAC Name]
1-Pentene, 3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)-, (3S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 41.3±8.0 °C at 760 mmHg
Vapour Pressure: 421.0±0.1 mmHg at 25°C
Enthalpy of Vaporization: 27.4±3.0 kJ/mol
Flash Point: -9.4±10.2 °C
Index of Refraction: 1.288
Molar Refractivity: 30.9±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 657.00
ACD/KOC (pH 5.5): 3617.57
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 657.00
ACD/KOC (pH 7.4): 3617.57
Polar Surface Area: 0 Å2
Polarizability: 12.3±0.5 10-24cm3
Surface Tension: 12.9±3.0 dyne/cm
Molar Volume: 171.9±3.0 cm3

Click to predict properties on the Chemicalize site


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