ChemSpider 2D Image | 3-Fluoro-4-methylbenzenesulfinic acid | C7H7FO2S

3-Fluoro-4-methylbenzenesulfinic acid

  • Molecular FormulaC7H7FO2S
  • Average mass174.193 Da
  • Monoisotopic mass174.015076 Da
  • ChemSpider ID61127194

More details:

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

3-Fluor-4-methylbenzolsulfinsäure [German] [ACD/IUPAC Name]
3-Fluoro-4-methylbenzenesulfinic acid [ACD/IUPAC Name]
Acide 3-fluoro-4-méthylbenzènesulfinique [French] [ACD/IUPAC Name]
Benzenesulfinic acid, 3-fluoro-4-methyl- [ACD/Index Name]
1233543-95-7 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 342.8±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.9±3.0 kJ/mol
Flash Point: 161.1±30.7 °C
Index of Refraction: 1.622
Molar Refractivity: 41.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.80
ACD/LogD (pH 5.5): -2.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 57 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 66.1±5.0 dyne/cm
Molar Volume: 119.0±5.0 cm3

Click to predict properties on the Chemicalize site


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