ChemSpider 2D Image | 4-Chloro-N-[2-(hydroxymethyl)cyclohexyl]-3-nitro-1H-pyrazole-5-carboxamide | C11H15ClN4O4

4-Chloro-N-[2-(hydroxymethyl)cyclohexyl]-3-nitro-1H-pyrazole-5-carboxamide

  • Molecular FormulaC11H15ClN4O4
  • Average mass302.714 Da
  • Monoisotopic mass302.078186 Da
  • ChemSpider ID67942262

More details:

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

1H-Pyrazole-5-carboxamide, 4-chloro-N-[2-(hydroxymethyl)cyclohexyl]-3-nitro- [ACD/Index Name]
4-Chlor-N-[2-(hydroxymethyl)cyclohexyl]-3-nitro-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
4-Chloro-N-[2-(hydroxymethyl)cyclohexyl]-3-nitro-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
4-Chloro-N-[2-(hydroxyméthyl)cyclohexyl]-3-nitro-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 540.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.1±3.0 kJ/mol
Flash Point: 280.8±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 69.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.33
ACD/LogD (pH 5.5): -0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.86
ACD/LogD (pH 7.4): -1.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 124 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 75.0±5.0 dyne/cm
Molar Volume: 201.3±5.0 cm3

Click to predict properties on the Chemicalize site


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