ChemSpider 2D Image | 2-(3-Methyl-4-nitrophenoxy)butanoyl chloride | C11H12ClNO4

2-(3-Methyl-4-nitrophenoxy)butanoyl chloride

  • Molecular FormulaC11H12ClNO4
  • Average mass257.670 Da
  • Monoisotopic mass257.045471 Da
  • ChemSpider ID23079277

More details:

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

2-(3-Methyl-4-nitrophenoxy)butanoyl chloride [ACD/IUPAC Name]
2-(3-Methyl-4-nitrophenoxy)butanoylchlorid [German] [ACD/IUPAC Name]
Butanoyl chloride, 2-(3-methyl-4-nitrophenoxy)- [ACD/Index Name]
Chlorure de 2-(3-méthyl-4-nitrophénoxy)butanoyle [French] [ACD/IUPAC Name]
1160257-48-6 [RN]
butanoyl chloride, 2-(3-methyl-4-nitrophenoxy)
MFCD12197827 [MDL number]
VS-04690

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 368.3±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.5±3.0 kJ/mol
    Flash Point: 176.6±23.7 °C
    Index of Refraction: 1.543
    Molar Refractivity: 63.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.31
    ACD/LogD (pH 5.5): 3.16
    ACD/BCF (pH 5.5): 149.81
    ACD/KOC (pH 5.5): 1255.61
    ACD/LogD (pH 7.4): 3.16
    ACD/BCF (pH 7.4): 149.81
    ACD/KOC (pH 7.4): 1255.61
    Polar Surface Area: 72 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 44.8±3.0 dyne/cm
    Molar Volume: 200.0±3.0 cm3

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