ChemSpider 2D Image | 5-Chloro-N-[2-(5-fluoro-1H-benzimidazol-2-yl)ethyl]-2-pyrimidinamine | C13H11ClFN5

5-Chloro-N-[2-(5-fluoro-1H-benzimidazol-2-yl)ethyl]-2-pyrimidinamine

  • Molecular FormulaC13H11ClFN5
  • Average mass291.711 Da
  • Monoisotopic mass291.068695 Da
  • ChemSpider ID65108056

More details:

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

1H-Benzimidazole-2-ethanamine, N-(5-chloro-2-pyrimidinyl)-5-fluoro- [ACD/Index Name]
5-Chlor-N-[2-(5-fluor-1H-benzimidazol-2-yl)ethyl]-2-pyrimidinamin [German] [ACD/IUPAC Name]
5-Chloro-N-[2-(5-fluoro-1H-benzimidazol-2-yl)ethyl]-2-pyrimidinamine [ACD/IUPAC Name]
5-Chloro-N-[2-(5-fluoro-1H-benzimidazol-2-yl)éthyl]-2-pyrimidinamine [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: 568.8±58.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.8±32.3 °C
Index of Refraction: 1.716
Molar Refractivity: 76.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 36.61
ACD/KOC (pH 5.5): 403.46
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.73
ACD/KOC (pH 7.4): 625.30
Polar Surface Area: 66 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 72.4±3.0 dyne/cm
Molar Volume: 194.4±3.0 cm3

Click to predict properties on the Chemicalize site


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