ChemSpider 2D Image | Ethyl 5-chloro-1-(2-nitrophenyl)-1H-pyrazole-4-carboxylate | C12H10ClN3O4

Ethyl 5-chloro-1-(2-nitrophenyl)-1H-pyrazole-4-carboxylate

  • Molecular FormulaC12H10ClN3O4
  • Average mass295.678 Da
  • Monoisotopic mass295.035980 Da
  • ChemSpider ID24745951

More details:

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

121716-35-6 [RN]
1H-Pyrazole-4-carboxylic acid, 5-chloro-1-(2-nitrophenyl)-, ethyl ester [ACD/Index Name]
5-Chloro-1-(2-nitrophényl)-1H-pyrazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-chloro-1-(2-nitrophenyl)-1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
Ethyl-5-chlor-1-(2-nitrophenyl)-1H-pyrazol-4-carboxylat [German] [ACD/IUPAC Name]
5-chloro-1-(2-nitrophenyl)-1h-pyrazole-4-carboxylic acid ethyl ester
ETHYL 5-CHLORO-1-(2-NITROPHENYL)PYRAZOLE-4-CARBOXYLATE
Ethyl 5-nitro-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
ethyl 5-nitropyrazole-3-carboxylate
ethyl5-chloro-1-(2-nitrophenyl)-1H-pyrazole-4-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 440.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.7±3.0 kJ/mol
    Flash Point: 220.0±25.9 °C
    Index of Refraction: 1.633
    Molar Refractivity: 72.1±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.90
    ACD/LogD (pH 5.5): 3.19
    ACD/BCF (pH 5.5): 156.52
    ACD/KOC (pH 5.5): 1295.61
    ACD/LogD (pH 7.4): 3.19
    ACD/BCF (pH 7.4): 156.52
    ACD/KOC (pH 7.4): 1295.61
    Polar Surface Area: 90 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 56.5±7.0 dyne/cm
    Molar Volume: 201.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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