ChemSpider 2D Image | Diethyl (2-bromo-4-nitrophenyl)(methyl)malonate | C14H16BrNO6

Diethyl (2-bromo-4-nitrophenyl)(methyl)malonate

  • Molecular FormulaC14H16BrNO6
  • Average mass374.184 Da
  • Monoisotopic mass373.016083 Da
  • ChemSpider ID34977418

More details:

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

(2-Bromo-4-nitrophényl)(méthyl)malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl (2-bromo-4-nitrophenyl)(methyl)malonate [ACD/IUPAC Name]
Diethyl-(2-brom-4-nitrophenyl)(methyl)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(2-bromo-4-nitrophenyl)-2-methyl-, diethyl ester [ACD/Index Name]
1,3-diethyl 2-(2-bromo-4-nitrophenyl)-2-methylpropanedioate
945244-26-8 [RN]
AGN-PC-0CRRZD
AK165877
Diethyl 2-(2-bromo-4-nitrophenyl)-2-methylmalonate
diethyl 2-(2-bromo-4-nitrophenyl)-2-methylpropanedioate
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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: 422.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.7±3.0 kJ/mol
    Flash Point: 209.3±28.7 °C
    Index of Refraction: 1.542
    Molar Refractivity: 81.0±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 3.36
    ACD/LogD (pH 5.5): 3.52
    ACD/BCF (pH 5.5): 278.33
    ACD/KOC (pH 5.5): 1956.25
    ACD/LogD (pH 7.4): 3.52
    ACD/BCF (pH 7.4): 278.33
    ACD/KOC (pH 7.4): 1956.25
    Polar Surface Area: 98 Å2
    Polarizability: 32.1±0.5 10-24cm3
    Surface Tension: 46.1±3.0 dyne/cm
    Molar Volume: 257.1±3.0 cm3

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