ChemSpider 2D Image | 1,1,1-Trifluoro-2,2-propanediol | C3H5F3O2

1,1,1-Trifluoro-2,2-propanediol

  • Molecular FormulaC3H5F3O2
  • Average mass130.066 Da
  • Monoisotopic mass130.024170 Da
  • ChemSpider ID61376283

More details:

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

1,1,1-Trifluor-2,2-propandiol [German] [ACD/IUPAC Name]
1,1,1-Trifluoro-2,2-propanediol [ACD/IUPAC Name]
1,1,1-Trifluoro-2,2-propanediol [French] [ACD/IUPAC Name]
2,2-Propanediol, 1,1,1-trifluoro- [ACD/Index Name]
421-76-1 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 145.3±35.0 °C at 760 mmHg
Vapour Pressure: 1.9±0.6 mmHg at 25°C
Enthalpy of Vaporization: 44.5±6.0 kJ/mol
Flash Point: 41.7±25.9 °C
Index of Refraction: 1.354
Molar Refractivity: 19.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.14
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 32.10
Polar Surface Area: 40 Å2
Polarizability: 7.7±0.5 10-24cm3
Surface Tension: 26.8±3.0 dyne/cm
Molar Volume: 89.5±3.0 cm3

Click to predict properties on the Chemicalize site


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