ChemSpider 2D Image | 2-Bromo-2-cycloundecen-1-yl 1,7,7-trimethylbicyclo[2.2.1]heptane-2-carboxylate | C22H35BrO2

2-Bromo-2-cycloundecen-1-yl 1,7,7-trimethylbicyclo[2.2.1]heptane-2-carboxylate

  • Molecular FormulaC22H35BrO2
  • Average mass411.416 Da
  • Monoisotopic mass410.182037 Da
  • ChemSpider ID28673232

More details:

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

1,7,7-Triméthylbicyclo[2.2.1]heptane-2-carboxylate de 2-bromo-2-cycloundécén-1-yle [French] [ACD/IUPAC Name]
2-Brom-2-cycloundecen-1-yl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-carboxylat [German] [ACD/IUPAC Name]
2-Bromo-2-cycloundecen-1-yl 1,7,7-trimethylbicyclo[2.2.1]heptane-2-carboxylate [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-2-carboxylic acid, 1,7,7-trimethyl-, 2-bromo-2-cycloundecen-1-yl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 449.0±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 225.3±26.8 °C
Index of Refraction: 1.531
Molar Refractivity: 107.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 8.98
ACD/LogD (pH 5.5): 7.62
ACD/BCF (pH 5.5): 365679.66
ACD/KOC (pH 5.5): 333918.63
ACD/LogD (pH 7.4): 7.62
ACD/BCF (pH 7.4): 365679.66
ACD/KOC (pH 7.4): 333918.63
Polar Surface Area: 26 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 40.4±5.0 dyne/cm
Molar Volume: 345.7±5.0 cm3

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