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Search term: QMOXBLQNFXWHNG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-cyclopentyl-3-nitropyrazole-4-carboxylic acid | C9H11N3O4

1-cyclopentyl-3-nitropyrazole-4-carboxylic acid

  • Molecular FormulaC9H11N3O4
  • Average mass225.201 Da
  • Monoisotopic mass225.074951 Da
  • ChemSpider ID32695270

More details:

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

1795473-86-7 [RN]
1-Cyclopentyl-3-nitro-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-Cyclopentyl-3-nitro-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
1-cyclopentyl-3-nitropyrazole-4-carboxylic acid
1H-Pyrazole-4-carboxylic acid, 1-cyclopentyl-3-nitro- [ACD/Index Name]
Acide 1-cyclopentyl-3-nitro-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
MFCD28155641
STL415397

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: 1.7±0.1 g/cm3
    Boiling Point: 450.3±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.7±3.0 kJ/mol
    Flash Point: 226.2±24.6 °C
    Index of Refraction: 1.713
    Molar Refractivity: 53.3±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.59
    ACD/LogD (pH 5.5): -1.48
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.57
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 101 Å2
    Polarizability: 21.1±0.5 10-24cm3
    Surface Tension: 77.2±7.0 dyne/cm
    Molar Volume: 135.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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