ChemSpider 2D Image | 5-Chloro-4-nitro-1-propyl-1H-pyrazole | C6H8ClN3O2

5-Chloro-4-nitro-1-propyl-1H-pyrazole

  • Molecular FormulaC6H8ClN3O2
  • Average mass189.600 Da
  • Monoisotopic mass189.030502 Da
  • ChemSpider ID28638246

More details:

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

1429309-41-0 [RN]
1H-Pyrazole, 5-chloro-4-nitro-1-propyl- [ACD/Index Name]
5-Chlor-4-nitro-1-propyl-1H-pyrazol [German] [ACD/IUPAC Name]
5-Chloro-4-nitro-1-propyl-1H-pyrazole [ACD/IUPAC Name]
5-Chloro-4-nitro-1-propyl-1H-pyrazole [French] [ACD/IUPAC Name]
5-chloro-4-nitro-1-propylpyrazole
5-chloro-4-nitro-1-propyl-pyrazole
MFCD22690771 [MDL number]

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

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 293.3±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.2±3.0 kJ/mol
    Flash Point: 131.2±21.8 °C
    Index of Refraction: 1.605
    Molar Refractivity: 44.7±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.19
    ACD/LogD (pH 5.5): 2.01
    ACD/BCF (pH 5.5): 19.95
    ACD/KOC (pH 5.5): 296.52
    ACD/LogD (pH 7.4): 2.01
    ACD/BCF (pH 7.4): 19.95
    ACD/KOC (pH 7.4): 296.52
    Polar Surface Area: 64 Å2
    Polarizability: 17.7±0.5 10-24cm3
    Surface Tension: 53.9±7.0 dyne/cm
    Molar Volume: 129.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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