ChemSpider 2D Image | 5-Chloro-1,3-dimethyl-4-[(4-nitro-1H-imidazol-1-yl)methyl]-1H-pyrazole | C9H10ClN5O2

5-Chloro-1,3-dimethyl-4-[(4-nitro-1H-imidazol-1-yl)methyl]-1H-pyrazole

  • Molecular FormulaC9H10ClN5O2
  • Average mass255.661 Da
  • Monoisotopic mass255.052307 Da
  • ChemSpider ID33233429

More details:

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

1H-Pyrazole, 5-chloro-1,3-dimethyl-4-[(4-nitro-1H-imidazol-1-yl)methyl]- [ACD/Index Name]
5-Chlor-1,3-dimethyl-4-[(4-nitro-1H-imidazol-1-yl)methyl]-1H-pyrazol [German] [ACD/IUPAC Name]
5-Chloro-1,3-dimethyl-4-[(4-nitro-1H-imidazol-1-yl)methyl]-1H-pyrazole [ACD/IUPAC Name]
5-Chloro-1,3-diméthyl-4-[(4-nitro-1H-imidazol-1-yl)méthyl]-1H-pyrazole [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 470.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 238.1±27.3 °C
Index of Refraction: 1.690
Molar Refractivity: 62.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.94
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 4.09
ACD/KOC (pH 5.5): 95.45
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 4.09
ACD/KOC (pH 7.4): 95.46
Polar Surface Area: 81 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 60.8±7.0 dyne/cm
Molar Volume: 164.5±7.0 cm3

Click to predict properties on the Chemicalize site


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