ChemSpider 2D Image | N-Propyl-N-{[2-(trifluoromethyl)phenyl]sulfonyl}glycine | C12H14F3NO4S

N-Propyl-N-{[2-(trifluoromethyl)phenyl]sulfonyl}glycine

  • Molecular FormulaC12H14F3NO4S
  • Average mass325.304 Da
  • Monoisotopic mass325.059570 Da
  • ChemSpider ID26412069

More details:

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

Glycine, N-propyl-N-[[2-(trifluoromethyl)phenyl]sulfonyl]- [ACD/Index Name]
N-Propyl-N-{[2-(trifluormethyl)phenyl]sulfonyl}glycin [German] [ACD/IUPAC Name]
N-Propyl-N-{[2-(trifluoromethyl)phenyl]sulfonyl}glycine [ACD/IUPAC Name]
N-Propyl-N-{[2-(trifluorométhyl)phényl]sulfonyl}glycine [French] [ACD/IUPAC Name]
2-{propyl[2-(trifluoromethyl)benzene]sulfonamido}acetic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 440.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 220.2±31.5 °C
Index of Refraction: 1.507
Molar Refractivity: 69.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.39
ACD/LogD (pH 7.4): -0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 232.6±3.0 cm3

Click to predict properties on the Chemicalize site


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