ChemSpider 2D Image | Methyl 2-bromobicyclo[2.2.1]heptane-1-carboxylate | C9H13BrO2

Methyl 2-bromobicyclo[2.2.1]heptane-1-carboxylate

  • Molecular FormulaC9H13BrO2
  • Average mass233.102 Da
  • Monoisotopic mass232.009888 Da
  • ChemSpider ID13465939

More details:

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

2-Bromobicyclo[2.2.1]heptane-1-carboxylate de méthyle [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-1-carboxylic acid, 2-bromo-, methyl ester [ACD/Index Name]
Methyl 2-bromobicyclo[2.2.1]heptane-1-carboxylate [ACD/IUPAC Name]
Methyl-2-brombicyclo[2.2.1]heptan-1-carboxylat [German] [ACD/IUPAC Name]
102450-73-7 [RN]
2-Bromo-bicyclo[2.2.1]heptane-1-carboxylic acid methyl ester
AGN-PC-0033D4
methyl 3-bromobicyclo[2.2.1]heptane-4-carboxylate
methyl exo-2-bromonorbornane-1-carboxylate
SCHEMBL905297

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 249.3±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.7±3.0 kJ/mol
    Flash Point: 104.6±22.6 °C
    Index of Refraction: 1.558
    Molar Refractivity: 49.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.23
    ACD/LogD (pH 5.5): 2.80
    ACD/BCF (pH 5.5): 79.61
    ACD/KOC (pH 5.5): 798.61
    ACD/LogD (pH 7.4): 2.80
    ACD/BCF (pH 7.4): 79.61
    ACD/KOC (pH 7.4): 798.61
    Polar Surface Area: 26 Å2
    Polarizability: 19.4±0.5 10-24cm3
    Surface Tension: 49.0±3.0 dyne/cm
    Molar Volume: 151.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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