ChemSpider 2D Image | 3-Bromo-1,2-oxazole-4-carbaldehyde | C4H2BrNO2

3-Bromo-1,2-oxazole-4-carbaldehyde

  • Molecular FormulaC4H2BrNO2
  • Average mass175.968 Da
  • Monoisotopic mass174.926880 Da
  • ChemSpider ID44774293

More details:

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

3-Brom-1,2-oxazol-4-carbaldehyd [German] [ACD/IUPAC Name]
3-Bromo-1,2-oxazole-4-carbaldehyde [ACD/IUPAC Name]
3-Bromo-1,2-oxazole-4-carbaldéhyde [French] [ACD/IUPAC Name]
4-Isoxazolecarboxaldehyde, 3-bromo- [ACD/Index Name]
1555762-80-5 [RN]
MFCD32745932

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

Density: 1.9±0.1 g/cm3
Boiling Point: 270.0±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.8±3.0 kJ/mol
Flash Point: 117.1±21.8 °C
Index of Refraction: 1.581
Molar Refractivity: 31.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.31
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.83
ACD/KOC (pH 5.5): 53.63
ACD/LogD (pH 7.4): 0.65
ACD/BCF (pH 7.4): 1.83
ACD/KOC (pH 7.4): 53.63
Polar Surface Area: 43 Å2
Polarizability: 12.3±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 93.3±3.0 cm3

Click to predict properties on the Chemicalize site


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