ChemSpider 2D Image | 3-Methyl-1,4-dinitropyrazolidine | C4H8N4O4

3-Methyl-1,4-dinitropyrazolidine

  • Molecular FormulaC4H8N4O4
  • Average mass176.131 Da
  • Monoisotopic mass176.054550 Da
  • ChemSpider ID109608738

More details:

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

3-Methyl-1,4-dinitropyrazolidin [German] [ACD/IUPAC Name]
3-Methyl-1,4-dinitropyrazolidine [ACD/IUPAC Name]
3-Méthyl-1,4-dinitropyrazolidine [French] [ACD/IUPAC Name]
Pyrazolidine, 3-methyl-1,4-dinitro- [ACD/Index 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: 322.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 148.6±28.7 °C
Index of Refraction: 1.565
Molar Refractivity: 38.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.17
ACD/LogD (pH 7.4): -1.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.45
Polar Surface Area: 107 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 62.4±5.0 dyne/cm
Molar Volume: 117.0±5.0 cm3

Click to predict properties on the Chemicalize site


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