ChemSpider 2D Image | 5-(2-Bromo-1,1-diethoxyethyl)-3-methyl-1,2,4-oxadiazole | C9H15BrN2O3

5-(2-Bromo-1,1-diethoxyethyl)-3-methyl-1,2,4-oxadiazole

  • Molecular FormulaC9H15BrN2O3
  • Average mass279.131 Da
  • Monoisotopic mass278.026611 Da
  • ChemSpider ID21410861

More details:

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

1,2,4-Oxadiazole, 5-(2-bromo-1,1-diethoxyethyl)-3-methyl- [ACD/Index Name]
5-(2-Brom-1,1-diethoxyethyl)-3-methyl-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
5-(2-Bromo-1,1-diethoxyethyl)-3-methyl-1,2,4-oxadiazole [ACD/IUPAC Name]
5-(2-Bromo-1,1-diéthoxyéthyl)-3-méthyl-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
87224-09-7 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 334.5±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 156.1±30.7 °C
Index of Refraction: 1.494
Molar Refractivity: 58.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 53.81
ACD/KOC (pH 5.5): 603.37
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 53.81
ACD/KOC (pH 7.4): 603.37
Polar Surface Area: 57 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 200.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement