ChemSpider 2D Image | 4-Fluoro-3-nitrophenyl trifluoromethanesulfonate | C7H3F4NO5S

4-Fluoro-3-nitrophenyl trifluoromethanesulfonate

  • Molecular FormulaC7H3F4NO5S
  • Average mass289.161 Da
  • Monoisotopic mass288.966797 Da
  • ChemSpider ID29304410

More details:

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

1448854-67-8 [RN]
4-Fluor-3-nitrophenyl-trifluormethansulfonat [German] [ACD/IUPAC Name]
4-Fluoro-3-nitrophenyl trifluoromethanesulfonate [ACD/IUPAC Name]
Methanesulfonic acid, 1,1,1-trifluoro-, 4-fluoro-3-nitrophenyl ester [ACD/Index Name]
Trifluorométhanesulfonate de 4-fluoro-3-nitrophényle [French] [ACD/IUPAC Name]
4-Fluoro-3-nitrophenyl trifluoromethanesulphonate
MFCD25976473

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

Density: 1.7±0.1 g/cm3
Boiling Point: 324.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.4±3.0 kJ/mol
Flash Point: 150.2±27.9 °C
Index of Refraction: 1.492
Molar Refractivity: 48.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 100.55
ACD/KOC (pH 5.5): 943.86
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 100.55
ACD/KOC (pH 7.4): 943.86
Polar Surface Area: 98 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 166.9±3.0 cm3

Click to predict properties on the Chemicalize site


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