ChemSpider 2D Image | 4-(5-Fluoro-1H-benzimidazol-2-yl)aniline | C13H10FN3

4-(5-Fluoro-1H-benzimidazol-2-yl)aniline

  • Molecular FormulaC13H10FN3
  • Average mass227.237 Da
  • Monoisotopic mass227.085876 Da
  • ChemSpider ID11385247

More details:






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

4-(5-Fluor-1H-benzimidazol-2-yl)anilin [German] [ACD/IUPAC Name]
4-(5-Fluoro-1H-benzimidazol-2-yl)aniline [ACD/IUPAC Name]
4-(5-Fluoro-1H-benzimidazol-2-yl)aniline [French] [ACD/IUPAC Name]
Benzenamine, 4-(5-fluoro-1H-benzimidazol-2-yl)- [ACD/Index Name]
4-(5-fluoro-1H-1,3-benzodiazol-2-yl)aniline
872552-44-8 [RN]
MFCD12603544 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 469.0±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.1±3.0 kJ/mol
Flash Point: 237.5±30.4 °C
Index of Refraction: 1.713
Molar Refractivity: 65.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.69
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 12.04
ACD/KOC (pH 5.5): 168.82
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.18
ACD/KOC (pH 7.4): 339.07
Polar Surface Area: 55 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 166.9±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement