ChemSpider 2D Image | 3,3,3-Trifluoro-1,1-propanediol | C3H5F3O2

3,3,3-Trifluoro-1,1-propanediol

  • Molecular FormulaC3H5F3O2
  • Average mass130.066 Da
  • Monoisotopic mass130.024170 Da
  • ChemSpider ID26051020

More details:

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

1,1-Propanediol, 3,3,3-trifluoro- [ACD/Index Name]
3,3,3-Trifluor-1,1-propandiol [German] [ACD/IUPAC Name]
3,3,3-Trifluoro-1,1-propanediol [ACD/IUPAC Name]
3,3,3-Trifluoro-1,1-propanediol [French] [ACD/IUPAC Name]
1286734-83-5 [RN]
1309602-82-1 [RN]
460-40-2 [RN]
MFCD18384868 [MDL number]
MFCD23704323

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

Density: 1.4±0.1 g/cm3
Boiling Point: 180.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.7 mmHg at 25°C
Enthalpy of Vaporization: 48.5±6.0 kJ/mol
Flash Point: 62.7±25.9 °C
Index of Refraction: 1.352
Molar Refractivity: 19.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.44
ACD/LogD (pH 5.5): -0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.86
ACD/LogD (pH 7.4): -0.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.86
Polar Surface Area: 40 Å2
Polarizability: 7.7±0.5 10-24cm3
Surface Tension: 27.6±3.0 dyne/cm
Molar Volume: 89.8±3.0 cm3

Click to predict properties on the Chemicalize site


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