ChemSpider 2D Image | Methyl 2,3-dibenzyl-5-bromobenzoate | C22H19BrO2

Methyl 2,3-dibenzyl-5-bromobenzoate

  • Molecular FormulaC22H19BrO2
  • Average mass395.289 Da
  • Monoisotopic mass394.056824 Da
  • ChemSpider ID110801415

More details:

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

2,3-Dibenzyl-5-bromobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 5-bromo-2,3-bis(phenylmethyl)-, methyl ester [ACD/Index Name]
Methyl 2,3-dibenzyl-5-bromobenzoate [ACD/IUPAC Name]
Methyl-2,3-dibenzyl-5-brombenzoat [German] [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: 508.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 261.5±30.1 °C
Index of Refraction: 1.607
Molar Refractivity: 104.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.22
ACD/LogD (pH 5.5): 6.58
ACD/BCF (pH 5.5): 59302.00
ACD/KOC (pH 5.5): 90812.20
ACD/LogD (pH 7.4): 6.58
ACD/BCF (pH 7.4): 59302.00
ACD/KOC (pH 7.4): 90812.20
Polar Surface Area: 26 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 302.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement