ChemSpider 2D Image | 5-Bromo-2-methylene-3-pentynal | C6H5BrO

5-Bromo-2-methylene-3-pentynal

  • Molecular FormulaC6H5BrO
  • Average mass173.007 Da
  • Monoisotopic mass171.952377 Da
  • ChemSpider ID92749468

More details:

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

3-Pentynal, 5-bromo-2-methylene- [ACD/Index Name]
5-Brom-2-methylen-3-pentinal [German] [ACD/IUPAC Name]
5-Bromo-2-methylene-3-pentynal [ACD/IUPAC Name]
5-Bromo-2-méthylène-3-pentynal [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 244.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 111.0±10.5 °C
Index of Refraction: 1.520
Molar Refractivity: 35.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.73
ACD/KOC (pH 5.5): 261.42
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.73
ACD/KOC (pH 7.4): 261.42
Polar Surface Area: 17 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 116.3±3.0 cm3

Click to predict properties on the Chemicalize site


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