ChemSpider 2D Image | (4S)-4-(Trifluoromethyl)-1,3-dioxolan-2-one | C4H3F3O3

(4S)-4-(Trifluoromethyl)-1,3-dioxolan-2-one

  • Molecular FormulaC4H3F3O3
  • Average mass156.060 Da
  • Monoisotopic mass156.003433 Da
  • ChemSpider ID122904656

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-4-(Trifluormethyl)-1,3-dioxolan-2-on [German] [ACD/IUPAC Name]
(4S)-4-(Trifluoromethyl)-1,3-dioxolan-2-one [ACD/IUPAC Name]
(4S)-4-(Trifluorométhyl)-1,3-dioxolan-2-one [French] [ACD/IUPAC Name]
1,3-Dioxolan-2-one, 4-(trifluoromethyl)-, (4S)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 206.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.3±3.0 kJ/mol
Flash Point: 76.8±20.8 °C
Index of Refraction: 1.357
Molar Refractivity: 22.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.21
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.22
ACD/KOC (pH 5.5): 40.14
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.22
ACD/KOC (pH 7.4): 40.14
Polar Surface Area: 36 Å2
Polarizability: 8.7±0.5 10-24cm3
Surface Tension: 26.7±3.0 dyne/cm
Molar Volume: 100.4±3.0 cm3

Click to predict properties on the Chemicalize site


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