ChemSpider 2D Image | 3-Fluoro-2-nitrobenzenesulfinic acid | C6H4FNO4S

3-Fluoro-2-nitrobenzenesulfinic acid

  • Molecular FormulaC6H4FNO4S
  • Average mass205.164 Da
  • Monoisotopic mass204.984512 Da
  • ChemSpider ID113143931

More details:

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

3-Fluor-2-nitrobenzolsulfinsäure [German] [ACD/IUPAC Name]
3-Fluoro-2-nitrobenzenesulfinic acid [ACD/IUPAC Name]
Acide 3-fluoro-2-nitrobenzènesulfinique [French] [ACD/IUPAC Name]
Benzenesulfinic acid, 3-fluoro-2-nitro- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 467.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 236.7±31.5 °C
Index of Refraction: 1.677
Molar Refractivity: 43.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.24
ACD/LogD (pH 5.5): -3.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 17.2±0.5 10-24cm3
Surface Tension: 94.1±5.0 dyne/cm
Molar Volume: 114.9±5.0 cm3

Click to predict properties on the Chemicalize site


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