Found 60 results

Search term: MF = 'C_{13}H_{13}F_{4}NO_{3}S'
ChemSpider 2D Image | N-[3-Fluoro-4-(trifluoromethyl)phenyl]tetrahydro-2H-thiopyran-4-carboxamide 1,1-dioxide | C13H13F4NO3S

N-[3-Fluoro-4-(trifluoromethyl)phenyl]tetrahydro-2H-thiopyran-4-carboxamide 1,1-dioxide

  • Molecular FormulaC13H13F4NO3S
  • Average mass339.306 Da
  • Monoisotopic mass339.055237 Da
  • ChemSpider ID64929557

More details:

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

1,1-Dioxyde de N-[3-fluoro-4-(trifluorométhyl)phényl]tétrahydro-2H-thiopyrane-4-carboxamide [French] [ACD/IUPAC Name]
2H-Thiopyran-4-carboxamide, N-[3-fluoro-4-(trifluoromethyl)phenyl]tetrahydro-, 1,1-dioxide [ACD/Index Name]
N-[3-Fluor-4-(trifluormethyl)phenyl]tetrahydro-2H-thiopyran-4-carboxamid-1,1-dioxid [German] [ACD/IUPAC Name]
N-[3-Fluoro-4-(trifluoromethyl)phenyl]tetrahydro-2H-thiopyran-4-carboxamide 1,1-dioxide [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: 535.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.6±30.1 °C
Index of Refraction: 1.524
Molar Refractivity: 70.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.65
ACD/KOC (pH 5.5): 260.57
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.65
ACD/KOC (pH 7.4): 260.57
Polar Surface Area: 72 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 229.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement