ChemSpider 2D Image | (R)-[2,8-Bis(trifluoromethyl)-4-quinolinyl](2-piperidinyl)methanol | C17H16F6N2O

(R)-[2,8-Bis(trifluoromethyl)-4-quinolinyl](2-piperidinyl)methanol

  • Molecular FormulaC17H16F6N2O
  • Average mass378.312 Da
  • Monoisotopic mass378.116669 Da
  • ChemSpider ID34531400

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(R)-[2,8-Bis(trifluormethyl)-4-chinolinyl](2-piperidinyl)methanol [German] [ACD/IUPAC Name]
(R)-[2,8-Bis(trifluorométhyl)-4-quinoléinyl](2-pipéridinyl)méthanol [French] [ACD/IUPAC Name]
(R)-[2,8-Bis(trifluoromethyl)-4-quinolinyl](2-piperidinyl)methanol [ACD/IUPAC Name]
4-Quinolinemethanol, α-2-piperidinyl-2,8-bis(trifluoromethyl)-, (αR)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 415.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 205.2±27.3 °C
Index of Refraction: 1.519
Molar Refractivity: 83.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.33
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 2.95
ACD/KOC (pH 7.4): 24.42
Polar Surface Area: 45 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 36.5±3.0 dyne/cm
Molar Volume: 273.4±3.0 cm3

Click to predict properties on the Chemicalize site


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