ChemSpider 2D Image | Ethyl 4-bromo-3-cyclohexene-1-carboxylate | C9H13BrO2

Ethyl 4-bromo-3-cyclohexene-1-carboxylate

  • Molecular FormulaC9H13BrO2
  • Average mass233.102 Da
  • Monoisotopic mass232.009888 Da
  • ChemSpider ID28595260

More details:

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

1365272-96-3 [RN]
3-Cyclohexene-1-carboxylic acid, 4-bromo-, ethyl ester [ACD/Index Name]
4-Bromo-3-cyclohexène-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-bromo-3-cyclohexene-1-carboxylate [ACD/IUPAC Name]
ETHYL 4-BROMOCYCLOHEX-3-ENE-1-CARBOXYLATE
Ethyl-4-brom-3-cyclohexen-1-carboxylat [German] [ACD/IUPAC Name]
[1365272-96-3] [RN]
97%
Ethyl4-bromocyclohex-3-ene-1-carboxylate
MFCD21609657
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 259.7±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.7±3.0 kJ/mol
    Flash Point: 110.9±27.3 °C
    Index of Refraction: 1.521
    Molar Refractivity: 50.6±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.11
    ACD/LogD (pH 5.5): 3.02
    ACD/BCF (pH 5.5): 116.58
    ACD/KOC (pH 5.5): 1049.31
    ACD/LogD (pH 7.4): 3.02
    ACD/BCF (pH 7.4): 116.58
    ACD/KOC (pH 7.4): 1049.31
    Polar Surface Area: 26 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 41.2±3.0 dyne/cm
    Molar Volume: 166.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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