ChemSpider 2D Image | N-[3-(Methylsulfonyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide | C20H20F3N3O5S

N-[3-(Methylsulfonyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide

  • Molecular FormulaC20H20F3N3O5S
  • Average mass471.450 Da
  • Monoisotopic mass471.107574 Da
  • ChemSpider ID21727783

More details:

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

4-Piperidinecarboxamide, N-[3-(methylsulfonyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-[3-(Methylsulfonyl)phenyl]-1-[2-nitro-4-(trifluormethyl)phenyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-[3-(Methylsulfonyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-[3-(Méthylsulfonyl)phényl]-1-[2-nitro-4-(trifluorométhyl)phényl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-(3-METHANESULFONYLPHENYL)-1-[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]PIPERIDINE-4-CARBOXAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 685.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 368.3±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 109.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 219.24
ACD/KOC (pH 5.5): 1649.05
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 219.24
ACD/KOC (pH 7.4): 1649.06
Polar Surface Area: 121 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 327.4±3.0 cm3

Click to predict properties on the Chemicalize site


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