ChemSpider 2D Image | Diethyl 5-(1-bromo-2,2-diphenylvinyl)-4,6,6-trimethyl-3,6-dihydro-2H-pyran-2,2-dicarboxylate | C28H31BrO5

Diethyl 5-(1-bromo-2,2-diphenylvinyl)-4,6,6-trimethyl-3,6-dihydro-2H-pyran-2,2-dicarboxylate

  • Molecular FormulaC28H31BrO5
  • Average mass527.447 Da
  • Monoisotopic mass526.135498 Da
  • ChemSpider ID21118768

More details:

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

2H-Pyran-2,2-dicarboxylic acid, 5-(1-bromo-2,2-diphenylethenyl)-3,6-dihydro-4,6,6-trimethyl-, diethyl ester [ACD/Index Name]
5-(1-Bromo-2,2-diphénylvinyl)-4,6,6-triméthyl-3,6-dihydro-2H-pyrane-2,2-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 5-(1-bromo-2,2-diphenylvinyl)-4,6,6-trimethyl-3,6-dihydro-2H-pyran-2,2-dicarboxylate [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 556.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.5±30.1 °C
Index of Refraction: 1.561
Molar Refractivity: 135.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.54
ACD/LogD (pH 5.5): 7.93
ACD/BCF (pH 5.5): 628345.75
ACD/KOC (pH 5.5): 491950.31
ACD/LogD (pH 7.4): 7.93
ACD/BCF (pH 7.4): 628345.75
ACD/KOC (pH 7.4): 491950.31
Polar Surface Area: 62 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 417.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement