ChemSpider 2D Image | 3-(5-Bromo-3-pyridinyl)-1,2,4-oxadiazole-5-carbaldehyde | C8H4BrN3O2

3-(5-Bromo-3-pyridinyl)-1,2,4-oxadiazole-5-carbaldehyde

  • Molecular FormulaC8H4BrN3O2
  • Average mass254.040 Da
  • Monoisotopic mass252.948685 Da
  • ChemSpider ID36981713

More details:

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

1,2,4-Oxadiazole-5-carboxaldehyde, 3-(5-bromo-3-pyridinyl)- [ACD/Index Name]
3-(5-Brom-3-pyridinyl)-1,2,4-oxadiazol-5-carbaldehyd [German] [ACD/IUPAC Name]
3-(5-Bromo-3-pyridinyl)-1,2,4-oxadiazole-5-carbaldehyde [ACD/IUPAC Name]
3-(5-Bromo-3-pyridinyl)-1,2,4-oxadiazole-5-carbaldéhyde [French] [ACD/IUPAC Name]
1501800-68-5 [RN]
MFCD23853849

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

Density: 1.8±0.1 g/cm3
Boiling Point: 408.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 201.1±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 51.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.67
ACD/KOC (pH 5.5): 88.19
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.67
ACD/KOC (pH 7.4): 88.19
Polar Surface Area: 69 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 65.5±3.0 dyne/cm
Molar Volume: 145.0±3.0 cm3

Click to predict properties on the Chemicalize site


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