ChemSpider 2D Image | (6R)-6-(4-Bromophenyl)-4-ethoxy-5,6-dihydro-2H-pyran-2-one | C13H13BrO3

(6R)-6-(4-Bromophenyl)-4-ethoxy-5,6-dihydro-2H-pyran-2-one

  • Molecular FormulaC13H13BrO3
  • Average mass297.145 Da
  • Monoisotopic mass296.004791 Da
  • ChemSpider ID30659240

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(6R)-6-(4-Bromophenyl)-4-ethoxy-5,6-dihydro-2H-pyran-2-one [ACD/IUPAC Name]
(6R)-6-(4-Bromophényl)-4-éthoxy-5,6-dihydro-2H-pyran-2-one [French] [ACD/IUPAC Name]
(6R)-6-(4-Bromphenyl)-4-ethoxy-5,6-dihydro-2H-pyran-2-on [German] [ACD/IUPAC Name]
2H-Pyran-2-one, 6-(4-bromophenyl)-4-ethoxy-5,6-dihydro-, (6R)- [ACD/Index 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: 436.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 217.8±28.7 °C
Index of Refraction: 1.587
Molar Refractivity: 68.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 121.69
ACD/KOC (pH 5.5): 1082.00
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 121.69
ACD/KOC (pH 7.4): 1082.00
Polar Surface Area: 36 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 48.0±5.0 dyne/cm
Molar Volume: 202.6±5.0 cm3

Click to predict properties on the Chemicalize site


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