ChemSpider 2D Image | 4-(Benzyloxy)-3-bromo-5-chlorobenzonitrile | C14H9BrClNO

4-(Benzyloxy)-3-bromo-5-chlorobenzonitrile

  • Molecular FormulaC14H9BrClNO
  • Average mass322.584 Da
  • Monoisotopic mass320.955597 Da
  • ChemSpider ID35510442

More details:

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

4-(Benzyloxy)-3-brom-5-chlorbenzonitril [German] [ACD/IUPAC Name]
4-(Benzyloxy)-3-bromo-5-chlorobenzonitrile [ACD/IUPAC Name]
4-(Benzyloxy)-3-bromo-5-chlorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-bromo-5-chloro-4-(phenylmethoxy)- [ACD/Index Name]
1823446-18-9 [RN]
3-bromo-5-chloro-4-phenylmethoxybenzonitrile
4-Benzyloxy-3-bromo-5-chloro-benzonitrile
MFCD28250888

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 409.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.2±3.0 kJ/mol
    Flash Point: 201.4±27.3 °C
    Index of Refraction: 1.645
    Molar Refractivity: 74.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.40
    ACD/LogD (pH 5.5): 4.76
    ACD/BCF (pH 5.5): 2436.25
    ACD/KOC (pH 5.5): 9242.98
    ACD/LogD (pH 7.4): 4.76
    ACD/BCF (pH 7.4): 2436.25
    ACD/KOC (pH 7.4): 9242.98
    Polar Surface Area: 33 Å2
    Polarizability: 29.7±0.5 10-24cm3
    Surface Tension: 59.2±5.0 dyne/cm
    Molar Volume: 206.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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