ChemSpider 2D Image | 1-[(2-Fluorophenyl)sulfonyl]-4-(trifluoromethyl)piperidine | C12H13F4NO2S

1-[(2-Fluorophenyl)sulfonyl]-4-(trifluoromethyl)piperidine

  • Molecular FormulaC12H13F4NO2S
  • Average mass311.296 Da
  • Monoisotopic mass311.060303 Da
  • ChemSpider ID48869229

More details:

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

1-[(2-Fluorophenyl)sulfonyl]-4-(trifluoromethyl)piperidine [ACD/IUPAC Name]
1-[(2-Fluorophényl)sulfonyl]-4-(trifluorométhyl)pipéridine [French] [ACD/IUPAC Name]
1-[(2-Fluorphenyl)sulfonyl]-4-(trifluormethyl)piperidin [German] [ACD/IUPAC Name]
Piperidine, 1-[(2-fluorophenyl)sulfonyl]-4-(trifluoromethyl)- [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: 355.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.1±3.0 kJ/mol
Flash Point: 168.8±30.7 °C
Index of Refraction: 1.503
Molar Refractivity: 65.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.61
ACD/KOC (pH 5.5): 776.93
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.61
ACD/KOC (pH 7.4): 776.93
Polar Surface Area: 46 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 222.1±3.0 cm3

Click to predict properties on the Chemicalize site


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