ChemSpider 2D Image | 4-Bromo-2-nitro-5-propoxy-N-propylaniline | C12H17BrN2O3

4-Bromo-2-nitro-5-propoxy-N-propylaniline

  • Molecular FormulaC12H17BrN2O3
  • Average mass317.179 Da
  • Monoisotopic mass316.042236 Da
  • ChemSpider ID28295263

More details:

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

1311197-83-7 [RN]
4-Brom-2-nitro-5-propoxy-N-propylanilin [German] [ACD/IUPAC Name]
4-Bromo-2-nitro-5-propoxy-N-propylaniline [ACD/IUPAC Name]
4-Bromo-2-nitro-5-propoxy-N-propylaniline [French] [ACD/IUPAC Name]
Benzenamine, 4-bromo-2-nitro-5-propoxy-N-propyl- [ACD/Index Name]
[1311197-83-7] [RN]
'1311197-83-7 [EINECS]
AN-2705
MFCD19237157

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: 417.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.1±3.0 kJ/mol
    Flash Point: 206.3±28.7 °C
    Index of Refraction: 1.578
    Molar Refractivity: 75.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.96
    ACD/LogD (pH 5.5): 4.22
    ACD/BCF (pH 5.5): 944.64
    ACD/KOC (pH 5.5): 4691.33
    ACD/LogD (pH 7.4): 4.22
    ACD/BCF (pH 7.4): 944.64
    ACD/KOC (pH 7.4): 4691.33
    Polar Surface Area: 67 Å2
    Polarizability: 29.9±0.5 10-24cm3
    Surface Tension: 45.0±3.0 dyne/cm
    Molar Volume: 226.9±3.0 cm3

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