ChemSpider 2D Image | 3,3-Difluoro-3-[2-(2-methyl-2-propanyl)phenyl]-1-propanol | C13H18F2O

3,3-Difluoro-3-[2-(2-methyl-2-propanyl)phenyl]-1-propanol

  • Molecular FormulaC13H18F2O
  • Average mass228.278 Da
  • Monoisotopic mass228.132568 Da
  • ChemSpider ID65448457

More details:

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

3,3-Difluor-3-[2-(2-methyl-2-propanyl)phenyl]-1-propanol [German] [ACD/IUPAC Name]
3,3-Difluoro-3-[2-(2-methyl-2-propanyl)phenyl]-1-propanol [ACD/IUPAC Name]
3,3-Difluoro-3-[2-(2-méthyl-2-propanyl)phényl]-1-propanol [French] [ACD/IUPAC Name]
Benzenepropanol, 2-(1,1-dimethylethyl)-γ,γ-difluoro- [ACD/Index Name]
2228672-55-5 [RN]
3-(2-tert-butylphenyl)-3,3-difluoropropan-1-ol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 316.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.9±3.0 kJ/mol
Flash Point: 145.2±26.5 °C
Index of Refraction: 1.473
Molar Refractivity: 60.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 4.03
ACD/BCF (pH 5.5): 681.43
ACD/KOC (pH 5.5): 3713.34
ACD/LogD (pH 7.4): 4.03
ACD/BCF (pH 7.4): 681.43
ACD/KOC (pH 7.4): 3713.34
Polar Surface Area: 20 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 29.3±3.0 dyne/cm
Molar Volume: 214.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement