ChemSpider 2D Image | ethyl 5-nitroindazolyl-3-carboxylate | C10H9N3O4

ethyl 5-nitroindazolyl-3-carboxylate

  • Molecular FormulaC10H9N3O4
  • Average mass235.196 Da
  • Monoisotopic mass235.059311 Da
  • ChemSpider ID22234803

More details:






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

1H-Indazole-3-carboxylic acid, 5-nitro-, ethyl ester [ACD/Index Name]
5-Nitro-1H-indazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
78155-85-8 [RN]
Ethyl 5-nitro-1H-indazole-3-carboxylate [ACD/IUPAC Name]
ethyl 5-nitroindazolyl-3-carboxylate
Ethyl-5-nitro-1H-indazol-3-carboxylat [German] [ACD/IUPAC Name]
1h-indazole-3-carboxylic acid,5-nitro-,ethyl ester
MFCD07371595 [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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 443.1±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 221.8±23.2 °C
    Index of Refraction: 1.660
    Molar Refractivity: 59.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.34
    ACD/LogD (pH 5.5): 2.06
    ACD/BCF (pH 5.5): 21.72
    ACD/KOC (pH 5.5): 315.17
    ACD/LogD (pH 7.4): 2.06
    ACD/BCF (pH 7.4): 21.60
    ACD/KOC (pH 7.4): 313.40
    Polar Surface Area: 101 Å2
    Polarizability: 23.6±0.5 10-24cm3
    Surface Tension: 69.0±3.0 dyne/cm
    Molar Volume: 161.3±3.0 cm3

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