ChemSpider 2D Image | 5-(3-Bromo-1,2,4-oxadiazol-5-yl)pyrimidine | C6H3BrN4O

5-(3-Bromo-1,2,4-oxadiazol-5-yl)pyrimidine

  • Molecular FormulaC6H3BrN4O
  • Average mass227.018 Da
  • Monoisotopic mass225.949020 Da
  • ChemSpider ID51605113

More details:

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

5-(3-Brom-1,2,4-oxadiazol-5-yl)pyrimidin [German] [ACD/IUPAC Name]
5-(3-Bromo-1,2,4-oxadiazol-5-yl)pyrimidine [ACD/IUPAC Name]
5-(3-Bromo-1,2,4-oxadiazol-5-yl)pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 5-(3-bromo-1,2,4-oxadiazol-5-yl)- [ACD/Index Name]
1592812-16-2 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 376.2±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 181.3±28.4 °C
Index of Refraction: 1.598
Molar Refractivity: 43.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 0.47
ACD/BCF (pH 5.5): 1.34
ACD/KOC (pH 5.5): 42.80
ACD/LogD (pH 7.4): 0.47
ACD/BCF (pH 7.4): 1.34
ACD/KOC (pH 7.4): 42.80
Polar Surface Area: 65 Å2
Polarizability: 17.1±0.5 10-24cm3
Surface Tension: 66.6±3.0 dyne/cm
Molar Volume: 126.6±3.0 cm3

Click to predict properties on the Chemicalize site


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