ChemSpider 2D Image | 2-(2-fluorophenyl)-1,2-benzothiazol-3-one | C13H8FNOS

2-(2-fluorophenyl)-1,2-benzothiazol-3-one

  • Molecular FormulaC13H8FNOS
  • Average mass245.272 Da
  • Monoisotopic mass245.031067 Da
  • ChemSpider ID14169400

More details:

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

1,2-Benzisothiazol-3(2H)-one, 2-(2-fluorophenyl)- [ACD/Index Name]
2-(2-Fluorophenyl)-1,2-benzothiazol-3(2H)-one [ACD/IUPAC Name]
2-(2-Fluorophényl)-1,2-benzothiazol-3(2H)-one [French] [ACD/IUPAC Name]
2-(2-fluorophenyl)-1,2-benzothiazol-3-one
2-(2-Fluorphenyl)-1,2-benzothiazol-3(2H)-on [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 384.7±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.3±3.0 kJ/mol
Flash Point: 186.5±28.4 °C
Index of Refraction: 1.677
Molar Refractivity: 65.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 171.71
ACD/KOC (pH 5.5): 1384.45
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 171.71
ACD/KOC (pH 7.4): 1384.45
Polar Surface Area: 46 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 56.8±3.0 dyne/cm
Molar Volume: 174.0±3.0 cm3

Click to predict properties on the Chemicalize site


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