ChemSpider 2D Image | Dimethyl 5-(bromomethyl)isophthalate | C11H11BrO4

Dimethyl 5-(bromomethyl)isophthalate

  • Molecular FormulaC11H11BrO4
  • Average mass287.107 Da
  • Monoisotopic mass285.984070 Da
  • ChemSpider ID25935377

More details:

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

1,3-Benzenedicarboxylic acid, 5-(bromomethyl)-, dimethyl ester [ACD/Index Name]
5-(Bromométhyl)isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-(bromomethyl)isophthalate [ACD/IUPAC Name]
Dimethyl 5-bromomethyl-1,3-benzenedicarboxylate
Dimethyl-5-(brommethyl)isophthalat [German] [ACD/IUPAC Name]
1,3-dimethyl 5-(bromomethyl)benzene-1,3-dicarboxylate
42268-88-2 [RN]
5-(Brommethyl)isophthalsaeure-dimethylester
5-(bromomethyl)isophthalicacid
dimethyl 5-(bromomethyl)isophthalate???ws202953???
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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: 372.3±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.9±3.0 kJ/mol
    Flash Point: 178.9±26.5 °C
    Index of Refraction: 1.554
    Molar Refractivity: 62.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.15
    ACD/LogD (pH 5.5): 2.94
    ACD/BCF (pH 5.5): 101.12
    ACD/KOC (pH 5.5): 947.70
    ACD/LogD (pH 7.4): 2.94
    ACD/BCF (pH 7.4): 101.12
    ACD/KOC (pH 7.4): 947.70
    Polar Surface Area: 53 Å2
    Polarizability: 24.8±0.5 10-24cm3
    Surface Tension: 45.6±3.0 dyne/cm
    Molar Volume: 194.7±3.0 cm3

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