ChemSpider 2D Image | N-(6-Fluoro-3,4-dihydro-2H-thiochromen-4-yl)-4-hydroxy-4-(trifluoromethyl)-1-piperidinecarboxamide | C16H18F4N2O2S

N-(6-Fluoro-3,4-dihydro-2H-thiochromen-4-yl)-4-hydroxy-4-(trifluoromethyl)-1-piperidinecarboxamide

  • Molecular FormulaC16H18F4N2O2S
  • Average mass378.385 Da
  • Monoisotopic mass378.102509 Da
  • ChemSpider ID77764040

More details:

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

1-Piperidinecarboxamide, N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-4-hydroxy-4-(trifluoromethyl)- [ACD/Index Name]
N-(6-Fluor-3,4-dihydro-2H-thiochromen-4-yl)-4-hydroxy-4-(trifluormethyl)-1-piperidincarboxamid [German] [ACD/IUPAC Name]
N-(6-Fluoro-3,4-dihydro-2H-thiochromen-4-yl)-4-hydroxy-4-(trifluoromethyl)-1-piperidinecarboxamide [ACD/IUPAC Name]
N-(6-Fluoro-3,4-dihydro-2H-thiochromén-4-yl)-4-hydroxy-4-(trifluorométhyl)-1-pipéridinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 513.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 264.5±30.1 °C
Index of Refraction: 1.582
Molar Refractivity: 86.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 97.11
ACD/KOC (pH 5.5): 920.68
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 97.11
ACD/KOC (pH 7.4): 920.66
Polar Surface Area: 78 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 52.3±5.0 dyne/cm
Molar Volume: 259.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement