ChemSpider 2D Image | Dimethyl (4-bromophenyl)malonate | C11H11BrO4

Dimethyl (4-bromophenyl)malonate

  • Molecular FormulaC11H11BrO4
  • Average mass287.107 Da
  • Monoisotopic mass285.984070 Da
  • ChemSpider ID15729814

More details:

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

(4-Bromophényl)malonate de diméthyle [French] [ACD/IUPAC Name]
149506-35-4 [RN]
Dimethyl (4-bromophenyl)malonate [ACD/IUPAC Name]
Dimethyl-(4-bromphenyl)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(4-bromophenyl)-, 1,3-dimethyl ester
Propanedioic acid, 2-(4-bromophenyl)-, dimethyl ester [ACD/Index Name]
1,3-dimethyl 2-(4-bromophenyl)propanedioate
2-(4-Bromophenyl)-malonic acid 1,3-dimethyl ester; (4-Bromophenyl)-malonic acid dimethyl ester; 2-(4-Bromophenyl)-malonic acid dimethyl ester; Dimethyl (4-Bromophenyl)-malonate
2-(4-Bromophenyl)malonic acid dimethyl ester
2-(4-Bromo-phenyl)-malonic acid dimethyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 330.0±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.3±3.0 kJ/mol
    Flash Point: 153.4±23.7 °C
    Index of Refraction: 1.535
    Molar Refractivity: 60.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.41
    ACD/LogD (pH 5.5): 2.66
    ACD/BCF (pH 5.5): 61.66
    ACD/KOC (pH 5.5): 665.13
    ACD/LogD (pH 7.4): 2.66
    ACD/BCF (pH 7.4): 61.65
    ACD/KOC (pH 7.4): 664.98
    Polar Surface Area: 53 Å2
    Polarizability: 24.2±0.5 10-24cm3
    Surface Tension: 43.3±3.0 dyne/cm
    Molar Volume: 195.7±3.0 cm3

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