ChemSpider 2D Image | 1-(1-{[2-Fluoro-5-(trifluoromethyl)phenyl]sulfonyl}-2-pyrrolidinyl)-N-methylmethanamine | C13H16F4N2O2S

1-(1-{[2-Fluoro-5-(trifluoromethyl)phenyl]sulfonyl}-2-pyrrolidinyl)-N-methylmethanamine

  • Molecular FormulaC13H16F4N2O2S
  • Average mass340.337 Da
  • Monoisotopic mass340.086853 Da
  • ChemSpider ID64094481

More details:

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

1-(1-{[2-Fluor-5-(trifluormethyl)phenyl]sulfonyl}-2-pyrrolidinyl)-N-methylmethanamin [German] [ACD/IUPAC Name]
1-(1-{[2-Fluoro-5-(trifluoromethyl)phenyl]sulfonyl}-2-pyrrolidinyl)-N-methylmethanamine [ACD/IUPAC Name]
1-(1-{[2-Fluoro-5-(trifluorométhyl)phényl]sulfonyl}-2-pyrrolidinyl)-N-méthylméthanamine [French] [ACD/IUPAC Name]
2-Pyrrolidinemethanamine, 1-[[2-fluoro-5-(trifluoromethyl)phenyl]sulfonyl]-N-methyl- [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: 391.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.2±3.0 kJ/mol
Flash Point: 190.8±30.7 °C
Index of Refraction: 1.500
Molar Refractivity: 73.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): -0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.28
Polar Surface Area: 58 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 251.1±3.0 cm3

Click to predict properties on the Chemicalize site


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