ChemSpider 2D Image | 3-{2-[6-Chloro-2-(chloromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-1,1-dimethylurea | C12H15Cl2N5O

3-{2-[6-Chloro-2-(chloromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-1,1-dimethylurea

  • Molecular FormulaC12H15Cl2N5O
  • Average mass316.186 Da
  • Monoisotopic mass315.065369 Da
  • ChemSpider ID40855970

More details:

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

3-{2-[6-Chlor-2-(chlormethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-1,1-dimethylharnstoff [German] [ACD/IUPAC Name]
3-{2-[6-Chloro-2-(chloromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-1,1-dimethylurea [ACD/IUPAC Name]
3-{2-[6-Chloro-2-(chlorométhyl)-3H-imidazo[4,5-b]pyridin-3-yl]éthyl}-1,1-diméthylurée [French] [ACD/IUPAC Name]
Urea, N'-[2-[6-chloro-2-(chloromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl]-N,N-dimethyl- [ACD/Index 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: 559.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.1±3.0 kJ/mol
Flash Point: 292.0±30.1 °C
Index of Refraction: 1.647
Molar Refractivity: 79.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.06
ACD/KOC (pH 5.5): 275.91
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 18.11
ACD/KOC (pH 7.4): 276.74
Polar Surface Area: 63 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 50.8±7.0 dyne/cm
Molar Volume: 218.7±7.0 cm3

Click to predict properties on the Chemicalize site


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