ChemSpider 2D Image | 2-({1-[2-(Trifluoromethoxy)phenyl]ethyl}amino)-1-propanol | C12H16F3NO2

2-({1-[2-(Trifluoromethoxy)phenyl]ethyl}amino)-1-propanol

  • Molecular FormulaC12H16F3NO2
  • Average mass263.256 Da
  • Monoisotopic mass263.113312 Da
  • ChemSpider ID30125454

More details:

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

1-Propanol, 2-[[1-[2-(trifluoromethoxy)phenyl]ethyl]amino]- [ACD/Index Name]
2-({1-[2-(Trifluormethoxy)phenyl]ethyl}amino)-1-propanol [German] [ACD/IUPAC Name]
2-({1-[2-(Trifluoromethoxy)phenyl]ethyl}amino)-1-propanol [ACD/IUPAC Name]
2-({1-[2-(Trifluorométhoxy)phényl]éthyl}amino)-1-propanol [French] [ACD/IUPAC Name]
2-({1-[2-(TRIFLUOROMETHOXY)PHENYL]ETHYL}AMINO)PROPAN-1-OL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 312.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.4±3.0 kJ/mol
Flash Point: 142.7±27.9 °C
Index of Refraction: 1.476
Molar Refractivity: 61.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.04
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 3.86
ACD/KOC (pH 7.4): 45.34
Polar Surface Area: 41 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 219.6±3.0 cm3

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