ChemSpider 2D Image | 4-Bromo-N-butyl-5-methoxy-2-nitroaniline | C11H15BrN2O3

4-Bromo-N-butyl-5-methoxy-2-nitroaniline

  • Molecular FormulaC11H15BrN2O3
  • Average mass303.152 Da
  • Monoisotopic mass302.026611 Da
  • ChemSpider ID26535902

More details:

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

4-Brom-N-butyl-5-methoxy-2-nitroanilin [German] [ACD/IUPAC Name]
4-Bromo-N-butyl-5-methoxy-2-nitroaniline [ACD/IUPAC Name]
4-Bromo-N-butyl-5-méthoxy-2-nitroaniline [French] [ACD/IUPAC Name]
Benzenamine, 4-bromo-N-butyl-5-methoxy-2-nitro- [ACD/Index Name]
[1280786-70-0] [RN]
1280786-70-0 [RN]
AN-2676
MFCD18783110 [MDL number]

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

CCRIS 4693 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 405.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.8±3.0 kJ/mol
    Flash Point: 199.3±28.7 °C
    Index of Refraction: 1.587
    Molar Refractivity: 70.7±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.43
    ACD/LogD (pH 5.5): 3.88
    ACD/BCF (pH 5.5): 523.76
    ACD/KOC (pH 5.5): 3075.78
    ACD/LogD (pH 7.4): 3.88
    ACD/BCF (pH 7.4): 523.76
    ACD/KOC (pH 7.4): 3075.78
    Polar Surface Area: 67 Å2
    Polarizability: 28.0±0.5 10-24cm3
    Surface Tension: 46.0±3.0 dyne/cm
    Molar Volume: 210.4±3.0 cm3

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