ChemSpider 2D Image | N-{2-[3-Fluoro-5-(methylsulfonyl)phenoxy]ethyl}-1-propanamine | C12H18FNO3S

N-{2-[3-Fluoro-5-(methylsulfonyl)phenoxy]ethyl}-1-propanamine

  • Molecular FormulaC12H18FNO3S
  • Average mass275.340 Da
  • Monoisotopic mass275.099152 Da
  • ChemSpider ID81367293

More details:

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

1-Propanamine, N-[2-[3-fluoro-5-(methylsulfonyl)phenoxy]ethyl]- [ACD/Index Name]
N-{2-[3-Fluor-5-(methylsulfonyl)phenoxy]ethyl}-1-propanamin [German] [ACD/IUPAC Name]
N-{2-[3-Fluoro-5-(methylsulfonyl)phenoxy]ethyl}-1-propanamine [ACD/IUPAC Name]
N-{2-[3-Fluoro-5-(méthylsulfonyl)phénoxy]éthyl}-1-propanamine [French] [ACD/IUPAC Name]
1403894-72-3 [RN]
Mesdopetam
N-[2-(3-fluoro-5-methylsulfonylphenoxy)ethyl]propan-1-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 428.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 212.9±28.7 °C
Index of Refraction: 1.500
Molar Refractivity: 68.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.50
ACD/LogD (pH 5.5): -1.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.31
Polar Surface Area: 64 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 234.3±3.0 cm3

Click to predict properties on the Chemicalize site


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