ChemSpider 2D Image | Methyl N-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)glycyl-L-leucinate | C14H23N5O5

Methyl N-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)glycyl-L-leucinate

  • Molecular FormulaC14H23N5O5
  • Average mass341.363 Da
  • Monoisotopic mass341.169922 Da
  • ChemSpider ID30411742

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Leucine, N-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)glycyl-, methyl ester [ACD/Index Name]
Methyl N-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)glycyl-L-leucinate [ACD/IUPAC Name]
Methyl-N-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)glycyl-L-leucinat [German] [ACD/IUPAC Name]
N-(1,3-Diméthyl-4-nitro-1H-pyrazol-5-yl)glycyl-L-leucinate de méthyle [French] [ACD/IUPAC 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: 549.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 285.9±30.1 °C
Index of Refraction: 1.581
Molar Refractivity: 85.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.67
ACD/KOC (pH 5.5): 260.78
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.67
ACD/KOC (pH 7.4): 260.78
Polar Surface Area: 131 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 47.1±7.0 dyne/cm
Molar Volume: 256.5±7.0 cm3

Click to predict properties on the Chemicalize site


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