ChemSpider 2D Image | 4,6-Difluoro-2-(2-thienylethynyl)-1H-benzimidazole | C13H6F2N2S

4,6-Difluoro-2-(2-thienylethynyl)-1H-benzimidazole

  • Molecular FormulaC13H6F2N2S
  • Average mass260.262 Da
  • Monoisotopic mass260.021973 Da
  • ChemSpider ID85283412

More details:

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

1H-Benzimidazole, 4,6-difluoro-2-[2-(2-thienyl)ethynyl]- [ACD/Index Name]
4,6-Difluor-2-(2-thienylethinyl)-1H-benzimidazol [German] [ACD/IUPAC Name]
4,6-Difluoro-2-(2-thienylethynyl)-1H-benzimidazole [ACD/IUPAC Name]
4,6-Difluoro-2-(2-thiényléthynyl)-1H-benzimidazole [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 441.2±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.8±3.0 kJ/mol
Flash Point: 220.6±30.9 °C
Index of Refraction: 1.697
Molar Refractivity: 66.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 289.28
ACD/KOC (pH 5.5): 2003.20
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 142.77
ACD/KOC (pH 7.4): 988.68
Polar Surface Area: 57 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 68.8±5.0 dyne/cm
Molar Volume: 172.3±5.0 cm3

Click to predict properties on the Chemicalize site


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