ChemSpider 2D Image | 4-Nitro-N-[3-oxo-3-(1-pyrrolidinyl)propyl]benzenesulfonamide | C13H17N3O5S

4-Nitro-N-[3-oxo-3-(1-pyrrolidinyl)propyl]benzenesulfonamide

  • Molecular FormulaC13H17N3O5S
  • Average mass327.356 Da
  • Monoisotopic mass327.088898 Da
  • ChemSpider ID57421428

More details:

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

4-Nitro-N-(3-oxo-3-(pyrrolidin-1-yl)propyl)benzenesulfonamide
4-Nitro-N-[3-oxo-3-(1-pyrrolidinyl)propyl]benzenesulfonamide [ACD/IUPAC Name]
4-Nitro-N-[3-oxo-3-(1-pyrrolidinyl)propyl]benzènesulfonamide [French] [ACD/IUPAC Name]
4-Nitro-N-[3-oxo-3-(1-pyrrolidinyl)propyl]benzolsulfonamid [German] [ACD/IUPAC Name]
925886-35-7 [RN]
Benzenesulfonamide, 4-nitro-N-[3-oxo-3-(1-pyrrolidinyl)propyl]- [ACD/Index Name]
4-NITRO-N-[3-OXO-3-(PYRROLIDIN-1-YL)PROPYL]BENZENE-1-SULFONAMIDE
4-NITRO-N-[3-OXO-3-(PYRROLIDIN-1-YL)PROPYL]BENZENESULFONAMIDE
MFCD09432956

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 561.7±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.5±3.0 kJ/mol
    Flash Point: 293.5±32.9 °C
    Index of Refraction: 1.595
    Molar Refractivity: 79.6±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.43
    ACD/LogD (pH 5.5): 1.06
    ACD/BCF (pH 5.5): 3.77
    ACD/KOC (pH 5.5): 90.05
    ACD/LogD (pH 7.4): 1.06
    ACD/BCF (pH 7.4): 3.75
    ACD/KOC (pH 7.4): 89.40
    Polar Surface Area: 121 Å2
    Polarizability: 31.6±0.5 10-24cm3
    Surface Tension: 59.6±3.0 dyne/cm
    Molar Volume: 234.4±3.0 cm3

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