ChemSpider 2D Image | 1,3-Dimethyl-N-{2-[(2-methyl-2-propanyl)amino]ethyl}-4-nitro-1H-pyrazole-5-carboxamide | C12H21N5O3

1,3-Dimethyl-N-{2-[(2-methyl-2-propanyl)amino]ethyl}-4-nitro-1H-pyrazole-5-carboxamide

  • Molecular FormulaC12H21N5O3
  • Average mass283.327 Da
  • Monoisotopic mass283.164429 Da
  • ChemSpider ID35167691

More details:

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

1,3-Dimethyl-N-{2-[(2-methyl-2-propanyl)amino]ethyl}-4-nitro-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
1,3-Dimethyl-N-{2-[(2-methyl-2-propanyl)amino]ethyl}-4-nitro-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
1,3-Diméthyl-N-{2-[(2-méthyl-2-propanyl)amino]éthyl}-4-nitro-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-5-carboxamide, N-[2-[(1,1-dimethylethyl)amino]ethyl]-1,3-dimethyl-4-nitro- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 430.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 214.3±28.7 °C
Index of Refraction: 1.574
Molar Refractivity: 74.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.78
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 225.9±7.0 cm3

Click to predict properties on the Chemicalize site


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